N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide

Systemtic Name: N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Openeye Name: N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide CAS Name: N-cyclohexyl-2-[4-(2-methoxyphenyl)-1-piperazinyl]-5-[(3-methyl-1-oxobutyl)amino]benzamide IUPAC Name: N-cyclohexyl-2-[4-(2-methoxyphenyl)piperazin-1-yl]-5-(3-methylbutanoylamino)benzamide Traditional Name: N-cyclohexyl-5-(isovalerylamino)-2-[4-(2-methoxyphenyl)piperazino]benzamide Formula: C29H40N4O3 MolecularWeight: 492.6529

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NC4CCCCC4

Isomeric SMILES

CC(C)CC(=O)NC1=CC(=C(C=C1)N2CCN(CC2)C3=CC=CC=C3OC)C(=O)NC4CCCCC4

InChI

InChI=1S/C29H40N4O3/c1-21(2)19-28(34)30-23-13-14-25(24(20-23)29(35)31-22-9-5-4-6-10-22)32-15-17-33(18-16-32)26-11-7-8-12-27(26)36-3/h7-8,11-14,20-22H,4-6,9-10,15-19H2,1-3H3,(H,30,34)(H,31,35)