[(S)-(4-chlorophenyl)-phenyl-methyl]-(1-methylpiperidin-1-ium-4-yl)azanium

Systemtic Name: [(S)-(4-chlorophenyl)-phenyl-methyl]-(1-methylpiperidin-1-ium-4-yl)azanium Openeye Name: [(S)-(4-chlorophenyl)-phenyl-methyl]-(1-methylpiperidin-1-ium-4-yl)ammonium CAS Name: [(S)-(4-chlorophenyl)-phenylmethyl]-(1-methyl-4-piperidin-1-iumyl)ammonium IUPAC Name: [(S)-(4-chlorophenyl)-phenylmethyl]-(1-methylpiperidin-1-ium-4-yl)azanium Traditional Name: [(S)-(4-chlorophenyl)-phenyl-methyl]-(1-methylpiperidin-1-ium-4-yl)ammonium Formula: C19H25ClN2+2 MolecularWeight: 316.8682

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)[NH2+]C(C2=CC=CC=C2)C3=CC=C(C=C3)Cl

Isomeric SMILES

C[NH+]1CCC(CC1)[NH2+][C@@H](C2=CC=CC=C2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H23ClN2/c1-22-13-11-18(12-14-22)21-19(15-5-3-2-4-6-15)16-7-9-17(20)10-8-16/h2-10,18-19,21H,11-14H2,1H3/p+2/t19-/m0/s1