N-[(1S,2S)-2-methylcyclohexyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]ethanamide

Systemtic Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]ethanamide Openeye Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-(o-tolylmethyl)piperazin-1-yl]acetamide CAS Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-[(2-methylphenyl)methyl]-1-piperazinyl]acetamide IUPAC Name: N-[(1S,2S)-2-methylcyclohexyl]-2-[4-[(2-methylphenyl)methyl]piperazin-1-yl]acetamide Traditional Name: 2-[4-(2-methylbenzyl)piperazino]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C21H33N3O MolecularWeight: 343.50622

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CN2CCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CN2CCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C21H33N3O/c1-17-7-3-5-9-19(17)15-23-11-13-24(14-12-23)16-21(25)22-20-10-6-4-8-18(20)2/h3,5,7,9,18,20H,4,6,8,10-16H2,1-2H3,(H,22,25)/t18-,20-/m0/s1