ethyl 1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-(1H-indol-3-ylmethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(1H-indol-3-ylmethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H23N2O2+ MolecularWeight: 287.37672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CNC3=CC=CC=C32

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H22N2O2/c1-2-21-17(20)13-7-9-19(10-8-13)12-14-11-18-16-6-4-3-5-15(14)16/h3-6,11,13,18H,2,7-10,12H2,1H3/p+1