(2R)-2-(4-chlorophenyl)-3-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]butanamide

Systemtic Name: (2R)-2-(4-chlorophenyl)-3-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]butanamide Openeye Name: (2R)-2-(4-chlorophenyl)-3-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]butanamide CAS Name: (2R)-2-(4-chlorophenyl)-3-methyl-N-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]butanamide IUPAC Name: (2R)-2-(4-chlorophenyl)-3-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]butanamide Traditional Name: (2R)-2-(4-chlorophenyl)-3-methyl-N-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]butyramide Formula: C23H36ClN2O+ MolecularWeight: 391.99774

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=C(C=C1)Cl)C(=O)NCC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

CC(C)[C@H](C1=CC=C(C=C1)Cl)C(=O)NCC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C23H35ClN2O/c1-18(2)21(19-9-11-20(24)12-10-19)22(27)25-17-23(13-5-3-6-14-23)26-15-7-4-8-16-26/h9-12,18,21H,3-8,13-17H2,1-2H3,(H,25,27)/p+1/t21-/m1/s1