2-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-1H-isoindole-1-carboxamide

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-isoindoline-1-carboxamide CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-[2-(3,4-dimethoxyphenyl)ethyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: 2-(5-bromo-2-methoxy-benzyl)-N-homoveratryl-3-keto-isoindoline-1-carboxamide Formula: C27H27BrN2O5 MolecularWeight: 539.41768

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CN2C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CN2C(C3=CC=CC=C3C2=O)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C27H27BrN2O5/c1-33-22-11-9-19(28)15-18(22)16-30-25(20-6-4-5-7-21(20)27(30)32)26(31)29-13-12-17-8-10-23(34-2)24(14-17)35-3/h4-11,14-15,25H,12-13,16H2,1-3H3,(H,29,31)