(3-chlorophenyl)-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidin-1-yl]methanone

Systemtic Name: (3-chlorophenyl)-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidin-1-yl]methanone Openeye Name: (3-chlorophenyl)-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]-1-piperidyl]methanone CAS Name: (3-chlorophenyl)-[4-[(3S)-3-methyl-1-piperidin-1-iumyl]-1-piperidinyl]methanone IUPAC Name: (3-chlorophenyl)-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidin-1-yl]methanone Traditional Name: (3-chlorophenyl)-[4-[(3S)-3-methylpiperidin-1-ium-1-yl]piperidino]methanone Formula: C18H26ClN2O+ MolecularWeight: 321.86484

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

Isomeric SMILES

C[C@H]1CCC[NH+](C1)C2CCN(CC2)C(=O)C3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H25ClN2O/c1-14-4-3-9-21(13-14)17-7-10-20(11-8-17)18(22)15-5-2-6-16(19)12-15/h2,5-6,12,14,17H,3-4,7-11,13H2,1H3/p+1/t14-/m0/s1