(3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methylpiperidin-4-yl)piperidin-1-ium-3-carboxamide

Systemtic Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methylpiperidin-4-yl)piperidin-1-ium-3-carboxamide Openeye Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methyl-4-piperidyl)piperidin-1-ium-3-carboxamide CAS Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methyl-4-piperidinyl)-3-piperidin-1-iumcarboxamide IUPAC Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methylpiperidin-4-yl)piperidin-1-ium-3-carboxamide Traditional Name: (3S)-N-[2-(4-chlorophenyl)ethyl]-1-(1-methyl-4-piperidyl)piperidin-1-ium-3-carboxamide Formula: C20H31ClN3O+ MolecularWeight: 364.93264

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)[NH+]2CCCC(C2)C(=O)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1CCC(CC1)[NH+]2CCC[C@@H](C2)C(=O)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H30ClN3O/c1-23-13-9-19(10-14-23)24-12-2-3-17(15-24)20(25)22-11-8-16-4-6-18(21)7-5-16/h4-7,17,19H,2-3,8-15H2,1H3,(H,22,25)/p+1/t17-/m0/s1