2-[2-[3,4-bis(oxidanyl)phenyl]ethylcarbamoyl]pyridine-3-carboxylate

Systemtic Name: 2-[2-[3,4-bis(oxidanyl)phenyl]ethylcarbamoyl]pyridine-3-carboxylate Openeye Name: 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]pyridine-3-carboxylate CAS Name: 2-[[2-(3,4-dihydroxyphenyl)ethylamino]-oxomethyl]-3-pyridinecarboxylate IUPAC Name: 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]pyridine-3-carboxylate Traditional Name: 2-[2-(3,4-dihydroxyphenyl)ethylcarbamoyl]nicotinate Formula: C15H13N2O5- MolecularWeight: 301.27412

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)C(=O)NCCC2=CC(=C(C=C2)O)O)C(=O)[O-]

Isomeric SMILES

C1=CC(=C(N=C1)C(=O)NCCC2=CC(=C(C=C2)O)O)C(=O)[O-]

InChI

InChI=1S/C15H14N2O5/c18-11-4-3-9(8-12(11)19)5-7-17-14(20)13-10(15(21)22)2-1-6-16-13/h1-4,6,8,18-19H,5,7H2,(H,17,20)(H,21,22)/p-1