methyl 2-[(4-benzamidopiperidin-1-ium-1-yl)methyl]furan-3-carboxylate

Systemtic Name: methyl 2-[(4-benzamidopiperidin-1-ium-1-yl)methyl]furan-3-carboxylate Openeye Name: methyl 2-[(4-benzamidopiperidin-1-ium-1-yl)methyl]furan-3-carboxylate CAS Name: 2-[(4-benzamido-1-piperidin-1-iumyl)methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[(4-benzamidopiperidin-1-ium-1-yl)methyl]furan-3-carboxylate Traditional Name: 2-[(4-benzamidopiperidin-1-ium-1-yl)methyl]furan-3-carboxylic acid methyl ester Formula: C19H23N2O4+ MolecularWeight: 343.39692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC=C1)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=C(OC=C1)C[NH+]2CCC(CC2)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H22N2O4/c1-24-19(23)16-9-12-25-17(16)13-21-10-7-15(8-11-21)20-18(22)14-5-3-2-4-6-14/h2-6,9,12,15H,7-8,10-11,13H2,1H3,(H,20,22)/p+1