2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-methylpropyl)-5-(octanoylamino)benzamide

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-methylpropyl)-5-(octanoylamino)benzamide Openeye Name: N-isobutyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(octanoylamino)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(2-methylpropyl)-5-(1-oxooctylamino)benzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(2-methylpropyl)-5-(octanoylamino)benzamide Traditional Name: 5-(caprylylamino)-N-isobutyl-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C30H44N4O3 MolecularWeight: 508.69536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC(C)C

Isomeric SMILES

CCCCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC(C)C

InChI

InChI=1S/C30H44N4O3/c1-5-6-7-8-9-14-29(35)32-24-15-16-26(25(21-24)30(36)31-22-23(2)3)33-17-19-34(20-18-33)27-12-10-11-13-28(27)37-4/h10-13,15-16,21,23H,5-9,14,17-20,22H2,1-4H3,(H,31,36)(H,32,35)