(2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1-cyanocyclohexyl)-N-methyl-propanamide

Systemtic Name: (2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1-cyanocyclohexyl)-N-methyl-propanamide Openeye Name: (2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1-cyanocyclohexyl)-N-methyl-propanamide CAS Name: (2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(1-cyanocyclohexyl)-N-methylpropanamide IUPAC Name: (2R)-2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(1-cyanocyclohexyl)-N-methylpropanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-N-methyl-2-(4-piperonylpiperazino)propionamide Formula: C23H32N4O3 MolecularWeight: 412.52518

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N(C)C1(CCCCC1)C#N)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C[C@H](C(=O)N(C)C1(CCCCC1)C#N)N2CCN(CC2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H32N4O3/c1-18(22(28)25(2)23(16-24)8-4-3-5-9-23)27-12-10-26(11-13-27)15-19-6-7-20-21(14-19)30-17-29-20/h6-7,14,18H,3-5,8-13,15,17H2,1-2H3/t18-/m1/s1