Products 76166-55-7

CAS 76166-55-7 is the registry number for Benafentrine (maleate). Offered by: MedChemExpress. Available pack sizes: Get quote.

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

N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid) (CAS 76166-55-7) is a chemical compound with the molecular formula C31H35N3O11 and a molecular weight of 625.6 g/mol. IUPAC name: N-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid). InChIKey: BWJFLHODOYZAML-GODXOYSCSA-N.

Identity
Molecular formulaC31H35N3O11
Molecular weight625.6 g/mol
IUPAC nameN-[4-[(4aR,10bS)-8,9-dimethoxy-2-methyl-3,4,4a,10b-tetrahydro-1H-benzo[c][1,6]naphthyridin-6-yl]phenyl]acetamide;bis((E)-but-2-enedioic acid)
InChIKeyBWJFLHODOYZAML-GODXOYSCSA-N
SMILESCC(=O)NC1=CC=C(C=C1)C2=N[C@H]3[C@@H](C4=CC(=C(C=C24)OC)OC)CN(CC3)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O

Computed by PubChem (NCBI)