N-(4-bromanyl-2-methyl-phenyl)-2,3-bis(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide

Systemtic Name: N-(4-bromanyl-2-methyl-phenyl)-2,3-bis(4-methoxyphenyl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxamide Openeye Name: N-(4-bromo-2-methyl-phenyl)-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide CAS Name: N-(4-bromo-2-methylphenyl)-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide IUPAC Name: N-(4-bromo-2-methylphenyl)-2,3-bis(4-methoxyphenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxamide Traditional Name: N-(4-bromo-2-methyl-phenyl)-1-keto-2,3-bis(4-methoxyphenyl)-3,4-dihydroisoquinoline-4-carboxamide Formula: C31H27BrN2O4 MolecularWeight: 571.46108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Br)NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

Isomeric SMILES

CC1=C(C=CC(=C1)Br)NC(=O)C2C(N(C(=O)C3=CC=CC=C23)C4=CC=C(C=C4)OC)C5=CC=C(C=C5)OC

InChI

InChI=1S/C31H27BrN2O4/c1-19-18-21(32)10-17-27(19)33-30(35)28-25-6-4-5-7-26(25)31(36)34(22-11-15-24(38-3)16-12-22)29(28)20-8-13-23(37-2)14-9-20/h4-18,28-29H,1-3H3,(H,33,35)