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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H44N4O3/c1-6-8-11-23(7-2)29(35)32-24-14-15-26(25(20-24)30(36)31-21-22(3)4)33-16-18-34(19-17-33)27-12-9-10-13-28(27)37-5/h9-10,12-15,20,22-23H,6-8,11,16-19,21H2,1-5H3,(H,31,36)(H,32,35)