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

Systemtic Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(octanoylamino)-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(octanoylamino)benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-(1-oxooctylamino)-N-propan-2-ylbenzamide IUPAC Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(octanoylamino)-N-propan-2-ylbenzamide Traditional Name: 5-(caprylylamino)-N-isopropyl-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C29H42N4O3 MolecularWeight: 494.66878

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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)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C29H42N4O3/c1-5-6-7-8-9-14-28(34)31-23-15-16-25(24(21-23)29(35)30-22(2)3)32-17-19-33(20-18-32)26-12-10-11-13-27(26)36-4/h10-13,15-16,21-22H,5-9,14,17-20H2,1-4H3,(H,30,35)(H,31,34)