5-(hexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(phenylmethyl)benzamide

Systemtic Name: 5-(hexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-5-(hexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-(1-oxohexylamino)-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-5-(hexanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: N-benzyl-5-(caproylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C31H38N4O3 MolecularWeight: 514.65842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CC=CC=C4

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C31H38N4O3/c1-3-4-6-15-30(36)33-25-16-17-27(26(22-25)31(37)32-23-24-11-7-5-8-12-24)34-18-20-35(21-19-34)28-13-9-10-14-29(28)38-2/h5,7-14,16-17,22H,3-4,6,15,18-21,23H2,1-2H3,(H,32,37)(H,33,36)