methyl 2-[[4-[(2-methoxyphenyl)carbamoyl]piperidin-1-ium-1-yl]methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[4-[(2-methoxyphenyl)carbamoyl]piperidin-1-ium-1-yl]methyl]furan-3-carboxylate Openeye Name: methyl 2-[[4-[(2-methoxyphenyl)carbamoyl]piperidin-1-ium-1-yl]methyl]furan-3-carboxylate CAS Name: 2-[[4-[(2-methoxyanilino)-oxomethyl]-1-piperidin-1-iumyl]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-[(2-methoxyphenyl)carbamoyl]piperidin-1-ium-1-yl]methyl]furan-3-carboxylate Traditional Name: 2-[[4-[(2-methoxyphenyl)carbamoyl]piperidin-1-ium-1-yl]methyl]furan-3-carboxylic acid methyl ester Formula: C20H25N2O5+ MolecularWeight: 373.4229

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)CC3=C(C=CO3)C(=O)OC

Isomeric SMILES

COC1=CC=CC=C1NC(=O)C2CC[NH+](CC2)CC3=C(C=CO3)C(=O)OC

InChI

InChI=1S/C20H24N2O5/c1-25-17-6-4-3-5-16(17)21-19(23)14-7-10-22(11-8-14)13-18-15(9-12-27-18)20(24)26-2/h3-6,9,12,14H,7-8,10-11,13H2,1-2H3,(H,21,23)/p+1