Products 131311-25-6

CAS 131311-25-6 is the registry number for TCV-309. Offered by: MedChemExpress. Available pack sizes: Get quote.

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

2-[3-(N-(5-bromo-1-propylpyridin-1-ium-3-carbonyl)anilino)propanoylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate nitrate (CAS 131311-25-6) is a chemical compound with the molecular formula C30H34BrN5O7 and a molecular weight of 656.5 g/mol. IUPAC name: 2-[3-(N-(5-bromo-1-propylpyridin-1-ium-3-carbonyl)anilino)propanoylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate nitrate. InChIKey: DVGLBKDNVHDMTD-UHFFFAOYSA-O.

Identity
Molecular formulaC30H34BrN5O7
Molecular weight656.5 g/mol
IUPAC name2-[3-(N-(5-bromo-1-propylpyridin-1-ium-3-carbonyl)anilino)propanoylamino]ethyl 3,4-dihydro-1H-isoquinoline-2-carboxylate nitrate
InChIKeyDVGLBKDNVHDMTD-UHFFFAOYSA-O
SMILESCCC[N+]1=CC(=CC(=C1)Br)C(=O)N(CCC(=O)NCCOC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4.[N+](=O)([O-])[O-]

Computed by PubChem (NCBI)

Synonyms: Tcv-309, orb1699166