2-[2-[(3-bromophenyl)-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)methyl]-1H-indol-3-yl]ethyl 3,4-dimethoxybenzoate

Systemtic Name: 2-[2-[(3-bromophenyl)-(1-methyl-2-oxidanyl-4-oxidanylidene-quinolin-3-yl)methyl]-1H-indol-3-yl]ethyl 3,4-dimethoxybenzoate Openeye Name: 2-[2-[(3-bromophenyl)-(2-hydroxy-1-methyl-4-oxo-3-quinolyl)methyl]-1H-indol-3-yl]ethyl 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid 2-[2-[(3-bromophenyl)-(2-hydroxy-1-methyl-4-oxo-3-quinolinyl)methyl]-1H-indol-3-yl]ethyl ester IUPAC Name: 2-[2-[(3-bromophenyl)-(2-hydroxy-1-methyl-4-oxoquinolin-3-yl)methyl]-1H-indol-3-yl]ethyl 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid 2-[2-[(3-bromophenyl)-(2-hydroxy-4-keto-1-methyl-3-quinolyl)methyl]-1H-indol-3-yl]ethyl ester Formula: C36H31BrN2O6 MolecularWeight: 667.54514

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C(=C1O)C(C3=CC(=CC=C3)Br)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC(=C(C=C6)OC)OC

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C(=C1O)C(C3=CC(=CC=C3)Br)C4=C(C5=CC=CC=C5N4)CCOC(=O)C6=CC(=C(C=C6)OC)OC

InChI

InChI=1S/C36H31BrN2O6/c1-39-28-14-7-5-12-26(28)34(40)32(35(39)41)31(21-9-8-10-23(37)19-21)33-25(24-11-4-6-13-27(24)38-33)17-18-45-36(42)22-15-16-29(43-2)30(20-22)44-3/h4-16,19-20,31,38,41H,17-18H2,1-3H3