ethyl 1-[(4-acetamidophenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-acetamidophenyl)methyl]-4-(2-methoxyethyl)-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-acetamidophenyl)methyl]-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-acetamidobenzyl)-4-(2-methoxyethyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C20H31N2O4+ MolecularWeight: 363.47114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C)CCOC

Isomeric SMILES

CCOC(=O)C1(CC[NH+](CC1)CC2=CC=C(C=C2)NC(=O)C)CCOC

InChI

InChI=1S/C20H30N2O4/c1-4-26-19(24)20(11-14-25-3)9-12-22(13-10-20)15-17-5-7-18(8-6-17)21-16(2)23/h5-8H,4,9-15H2,1-3H3,(H,21,23)/p+1