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

Systemtic Name: ethyl 1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-acetamidophenyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-acetamidophenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-acetamidobenzyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H25N2O3+ MolecularWeight: 305.392

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H24N2O3/c1-3-22-17(21)15-8-10-19(11-9-15)12-14-4-6-16(7-5-14)18-13(2)20/h4-7,15H,3,8-12H2,1-2H3,(H,18,20)/p+1