2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-[(1S,2S)-2-methylcyclohexyl]acetamide Traditional Name: N-[(1S,2S)-2-methylcyclohexyl]-2-(4-piperonylpiperazino)acetamide Formula: C21H31N3O3 MolecularWeight: 373.48914

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=O)CN2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H31N3O3/c1-16-4-2-3-5-18(16)22-21(25)14-24-10-8-23(9-11-24)13-17-6-7-19-20(12-17)27-15-26-19/h6-7,12,16,18H,2-5,8-11,13-15H2,1H3,(H,22,25)/t16-,18-/m0/s1