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

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-isoindoline-1-carboxamide CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-(2,3-dimethylcyclohexyl)-3-oxo-1H-isoindole-1-carboxamide Traditional Name: 2-(5-bromo-2-methoxy-benzyl)-N-(2,3-dimethylcyclohexyl)-3-keto-isoindoline-1-carboxamide Formula: C25H29BrN2O3 MolecularWeight: 485.41336

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=C(C=CC(=C4)Br)OC

Isomeric SMILES

CC1CCCC(C1C)NC(=O)C2C3=CC=CC=C3C(=O)N2CC4=C(C=CC(=C4)Br)OC

InChI

InChI=1S/C25H29BrN2O3/c1-15-7-6-10-21(16(15)2)27-24(29)23-19-8-4-5-9-20(19)25(30)28(23)14-17-13-18(26)11-12-22(17)31-3/h4-5,8-9,11-13,15-16,21,23H,6-7,10,14H2,1-3H3,(H,27,29)