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

Systemtic Name: 5-(3,3-dimethylbutanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-5-(3,3-dimethylbutanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide CAS Name: 5-[(3,3-dimethyl-1-oxobutyl)amino]-2-[4-(2-methoxyphenyl)-1-piperazinyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-5-(3,3-dimethylbutanoylamino)-2-[4-(2-methoxyphenyl)piperazin-1-yl]benzamide Traditional Name: N-benzyl-5-(3,3-dimethylbutanoylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C31H38N4O3 MolecularWeight: 514.65842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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