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

Systemtic Name: methyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Openeye Name: methyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[[4-[anilino(oxo)methyl]phenyl]methyl]-4-piperidin-1-iumcarboxylic acid methyl ester IUPAC Name: methyl 1-[[4-(phenylcarbamoyl)phenyl]methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-[4-(phenylcarbamoyl)benzyl]piperidin-1-ium-4-carboxylic acid methyl ester Formula: C21H25N2O3+ MolecularWeight: 353.4348

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H24N2O3/c1-26-21(25)18-11-13-23(14-12-18)15-16-7-9-17(10-8-16)20(24)22-19-5-3-2-4-6-19/h2-10,18H,11-15H2,1H3,(H,22,24)/p+1