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

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl]-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-oxidanylidene-1H-isoindole-1-carboxamide Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl]-N-[3-(3,5-dimethyl-1-piperidyl)propyl]-3-oxo-isoindoline-1-carboxamide CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-[3-(3,5-dimethyl-1-piperidinyl)propyl]-3-oxo-1H-isoindole-1-carboxamide IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl]-N-[3-(3,5-dimethylpiperidin-1-yl)propyl]-3-oxo-1H-isoindole-1-carboxamide Traditional Name: 2-(5-bromo-2-methoxy-benzyl)-N-[3-(3,5-dimethylpiperidino)propyl]-3-keto-isoindoline-1-carboxamide Formula: C27H34BrN3O3 MolecularWeight: 528.48116

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)CCCNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=C(C=CC(=C4)Br)OC)C

Isomeric SMILES

CC1CC(CN(C1)CCCNC(=O)C2C3=CC=CC=C3C(=O)N2CC4=C(C=CC(=C4)Br)OC)C

InChI

InChI=1S/C27H34BrN3O3/c1-18-13-19(2)16-30(15-18)12-6-11-29-26(32)25-22-7-4-5-8-23(22)27(33)31(25)17-20-14-21(28)9-10-24(20)34-3/h4-5,7-10,14,18-19,25H,6,11-13,15-17H2,1-3H3,(H,29,32)