5-[(2-bromophenyl)carbonylamino]-N-(3-ethoxypropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide

Systemtic Name: 5-[(2-bromophenyl)carbonylamino]-N-(3-ethoxypropyl)-2-[4-(phenylmethyl)piperidin-1-yl]benzamide Openeye Name: 2-(4-benzyl-1-piperidyl)-5-[(2-bromobenzoyl)amino]-N-(3-ethoxypropyl)benzamide CAS Name: 5-[[(2-bromophenyl)-oxomethyl]amino]-N-(3-ethoxypropyl)-2-[4-(phenylmethyl)-1-piperidinyl]benzamide IUPAC Name: 2-(4-benzylpiperidin-1-yl)-5-[(2-bromobenzoyl)amino]-N-(3-ethoxypropyl)benzamide Traditional Name: 2-(4-benzylpiperidino)-5-[(2-bromobenzoyl)amino]-N-(3-ethoxypropyl)benzamide Formula: C31H36BrN3O3 MolecularWeight: 578.53984

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Br)N3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCOCCCNC(=O)C1=C(C=CC(=C1)NC(=O)C2=CC=CC=C2Br)N3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C31H36BrN3O3/c1-2-38-20-8-17-33-30(36)27-22-25(34-31(37)26-11-6-7-12-28(26)32)13-14-29(27)35-18-15-24(16-19-35)21-23-9-4-3-5-10-23/h3-7,9-14,22,24H,2,8,15-21H2,1H3,(H,33,36)(H,34,37)