2-[(4-bromophenyl)methyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]-3-oxidanylidene-1H-isoindole-5-carboxamide

Systemtic Name: 2-[(4-bromophenyl)methyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]-3-oxidanylidene-1H-isoindole-5-carboxamide Openeye Name: 2-[(4-bromophenyl)methyl]-N-[3-(2-ethyl-1-piperidyl)propyl]-3-oxo-isoindoline-5-carboxamide CAS Name: 2-[(4-bromophenyl)methyl]-N-[3-(2-ethyl-1-piperidinyl)propyl]-3-oxo-1H-isoindole-5-carboxamide IUPAC Name: 2-[(4-bromophenyl)methyl]-N-[3-(2-ethylpiperidin-1-yl)propyl]-3-oxo-1H-isoindole-5-carboxamide Traditional Name: 2-(4-bromobenzyl)-N-[3-(2-ethylpiperidino)propyl]-3-keto-isoindoline-5-carboxamide Formula: C26H32BrN3O2 MolecularWeight: 498.45518

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC=C(C=C4)Br)C=C2

Isomeric SMILES

CCC1CCCCN1CCCNC(=O)C2=CC3=C(CN(C3=O)CC4=CC=C(C=C4)Br)C=C2

InChI

InChI=1S/C26H32BrN3O2/c1-2-23-6-3-4-14-29(23)15-5-13-28-25(31)20-9-10-21-18-30(26(32)24(21)16-20)17-19-7-11-22(27)12-8-19/h7-12,16,23H,2-6,13-15,17-18H2,1H3,(H,28,31)