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

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

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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)NC(C)C

Isomeric SMILES

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

InChI

InChI=1S/C29H42N4O3/c1-6-8-11-22(7-2)28(34)31-23-14-15-25(24(20-23)29(35)30-21(3)4)32-16-18-33(19-17-32)26-12-9-10-13-27(26)36-5/h9-10,12-15,20-22H,6-8,11,16-19H2,1-5H3,(H,30,35)(H,31,34)