ethyl 1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-carboxylate

Systemtic Name: ethyl 1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-carboxylate Openeye Name: ethyl 1-[(4-methoxy-3-methyl-phenyl)methyl]piperidin-1-ium-4-carboxylate CAS Name: 1-[(4-methoxy-3-methylphenyl)methyl]-4-piperidin-1-iumcarboxylic acid ethyl ester IUPAC Name: ethyl 1-[(4-methoxy-3-methylphenyl)methyl]piperidin-1-ium-4-carboxylate Traditional Name: 1-(4-methoxy-3-methyl-benzyl)piperidin-1-ium-4-carboxylic acid ethyl ester Formula: C17H26NO3+ MolecularWeight: 292.39324

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H25NO3/c1-4-21-17(19)15-7-9-18(10-8-15)12-14-5-6-16(20-3)13(2)11-14/h5-6,11,15H,4,7-10,12H2,1-3H3/p+1