N-(4-chlorophenyl)-2-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide chloride

Systemtic Name: N-(4-chlorophenyl)-2-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)ethanamide chloride Openeye Name: N-(4-chlorophenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-phenyl-acetamide chloride CAS Name: N-(4-chlorophenyl)-2-phenyl-N-(1-propan-2-yl-4-piperidin-1-iumyl)acetamide chloride IUPAC Name: N-(4-chlorophenyl)-2-phenyl-N-(1-propan-2-ylpiperidin-1-ium-4-yl)acetamide chloride Traditional Name: N-(4-chlorophenyl)-N-(1-isopropylpiperidin-1-ium-4-yl)-2-phenyl-acetamide chloride Formula: C22H28Cl2N2O MolecularWeight: 407.37652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCC(CC1)N(C2=CC=C(C=C2)Cl)C(=O)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC(C)[NH+]1CCC(CC1)N(C2=CC=C(C=C2)Cl)C(=O)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H27ClN2O.ClH/c1-17(2)24-14-12-21(13-15-24)25(20-10-8-19(23)9-11-20)22(26)16-18-6-4-3-5-7-18;/h3-11,17,21H,12-16H2,1-2H3;1H