N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3,5,5-trimethylhexanoylamino)benzamide

Systemtic Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3,5,5-trimethylhexanoylamino)benzamide Openeye Name: 2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-sec-butyl-5-(3,5,5-trimethylhexanoylamino)benzamide CAS Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3,5,5-trimethyl-1-oxohexyl)amino]benzamide IUPAC Name: N-butan-2-yl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3,5,5-trimethylhexanoylamino)benzamide Traditional Name: 2-[4-(2-methoxyphenyl)piperazino]-N-sec-butyl-5-(3,5,5-trimethylhexanoylamino)benzamide Formula: C31H46N4O3 MolecularWeight: 522.72194

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C31H46N4O3/c1-8-23(3)32-30(37)25-20-24(33-29(36)19-22(2)21-31(4,5)6)13-14-26(25)34-15-17-35(18-16-34)27-11-9-10-12-28(27)38-7/h9-14,20,22-23H,8,15-19,21H2,1-7H3,(H,32,37)(H,33,36)