2-piperidin-1-ium-1-ylethyl 1-phenylindole-2-carboxylate chloride

Systemtic Name: 2-piperidin-1-ium-1-ylethyl 1-phenylindole-2-carboxylate chloride Openeye Name: 2-piperidin-1-ium-1-ylethyl 1-phenylindole-2-carboxylate chloride CAS Name: 1-phenyl-2-indolecarboxylic acid 2-(1-piperidin-1-iumyl)ethyl ester chloride IUPAC Name: 2-piperidin-1-ium-1-ylethyl 1-phenylindole-2-carboxylate chloride Traditional Name: 1-phenylindole-2-carboxylic acid 2-piperidin-1-ium-1-ylethyl ester chloride Formula: C22H25ClN2O2 MolecularWeight: 384.8991

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](CC1)CCOC(=O)C2=CC3=CC=CC=C3N2C4=CC=CC=C4.[Cl-]

Isomeric SMILES

C1CC[NH+](CC1)CCOC(=O)C2=CC3=CC=CC=C3N2C4=CC=CC=C4.[Cl-]

InChI

InChI=1S/C22H24N2O2.ClH/c25-22(26-16-15-23-13-7-2-8-14-23)21-17-18-9-5-6-12-20(18)24(21)19-10-3-1-4-11-19;/h1,3-6,9-12,17H,2,7-8,13-16H2;1H