2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[4-[(2-methoxy-5-methyl-phenyl)methyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[4-[(2-methoxy-5-methylphenyl)methyl]-1-piperazinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: 2-[4-(2-methoxy-5-methyl-benzyl)piperazino]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Formula: C22H35N3O2 MolecularWeight: 373.5322

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CN2CCN(CC2)CC3=C(C=CC(=C3)C)OC

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CN2CCN(CC2)CC3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C22H35N3O2/c1-17-8-9-21(27-3)19(14-17)15-24-10-12-25(13-11-24)16-22(26)23-20-7-5-4-6-18(20)2/h8-9,14,18,20H,4-7,10-13,15-16H2,1-3H3,(H,23,26)/t18-,20-/m0/s1