Products 2137894-98-3

CAS 2137894-98-3 appears in our catalog under these names: NVOC cage–TMP–Halo, NVOC cage-TMP-Halo, 96.04%, NVOC cage-TMP-Halo. Offered by: GLPBio, MedChemExpress, Chemat. Available pack sizes: 1mg, 10mg, 5mg, 5 mg, 10 mg, 25mg.

Structural formula: {0} (CAS {1})

(4,5-dimethoxy-2-nitrophenyl)methyl N-[4-amino-5-[[4-[3-[[4-[2-[2-(6-chlorohexoxy)ethoxy]ethylamino]-4-oxobutanoyl]amino]propoxy]-3,5-dimethoxyphenyl]methyl]pyrimidin-2-yl]carbamate (CAS 2137894-98-3) is a chemical compound with the molecular formula C40H56ClN7O13 and a molecular weight of 878.4 g/mol. IUPAC name: (4,5-dimethoxy-2-nitrophenyl)methyl N-[4-amino-5-[[4-[3-[[4-[2-[2-(6-chlorohexoxy)ethoxy]ethylamino]-4-oxobutanoyl]amino]propoxy]-3,5-dimethoxyphenyl]methyl]pyrimidin-2-yl]carbamate. InChIKey: DUNVDVWPSITHRB-UHFFFAOYSA-N.

Identity
Molecular formulaC40H56ClN7O13
Molecular weight878.4 g/mol
IUPAC name(4,5-dimethoxy-2-nitrophenyl)methyl N-[4-amino-5-[[4-[3-[[4-[2-[2-(6-chlorohexoxy)ethoxy]ethylamino]-4-oxobutanoyl]amino]propoxy]-3,5-dimethoxyphenyl]methyl]pyrimidin-2-yl]carbamate
InChIKeyDUNVDVWPSITHRB-UHFFFAOYSA-N
SMILESCOC1=CC(=CC(=C1OCCCNC(=O)CCC(=O)NCCOCCOCCCCCCCl)OC)CC2=CN=C(N=C2N)NC(=O)OCC3=CC(=C(C=C3[N+](=O)[O-])OC)OC

Computed by PubChem (NCBI)