ethyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[4-[anilino(oxo)methyl]phenyl]methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[4-(phenylcarbamoyl)benzyl]piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1CC[NH+](CC1)CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H26N2O3/c1-2-27-22(26)19-12-14-24(15-13-19)16-17-8-10-18(11-9-17)21(25)23-20-6-4-3-5-7-20/h3-11,19H,2,12-16H2,1H3,(H,23,25)/p+1