3-(1-methylpiperidin-1-ium-2-yl)propyl 2,2-diphenylethanoate chloride

Systemtic Name: 3-(1-methylpiperidin-1-ium-2-yl)propyl 2,2-diphenylethanoate chloride Openeye Name: 3-(1-methylpiperidin-1-ium-2-yl)propyl 2,2-diphenylacetate chloride CAS Name: 2,2-diphenylacetic acid 3-(1-methyl-2-piperidin-1-iumyl)propyl ester chloride IUPAC Name: 3-(1-methylpiperidin-1-ium-2-yl)propyl 2,2-diphenylacetate chloride Traditional Name: 2,2-diphenylacetic acid 3-(1-methylpiperidin-1-ium-2-yl)propyl ester chloride Formula: C23H30ClNO2 MolecularWeight: 387.9428

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCCC1CCCOC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

C[NH+]1CCCCC1CCCOC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C23H29NO2.ClH/c1-24-17-9-8-15-21(24)16-10-18-26-23(25)22(19-11-4-2-5-12-19)20-13-6-3-7-14-20;/h2-7,11-14,21-22H,8-10,15-18H2,1H3;1H