6-[4-[(2-acetamido-3-oxidanyl-propanoyl)amino]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid

Systemtic Name: 6-[4-[(2-acetamido-3-oxidanyl-propanoyl)amino]phenyl]-2-oxidanylidene-1H-pyridine-3-carboxylic acid Openeye Name: 6-[4-[(2-acetamido-3-hydroxy-propanoyl)amino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid CAS Name: 6-[4-[(2-acetamido-3-hydroxy-1-oxopropyl)amino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid IUPAC Name: 6-[4-[(2-acetamido-3-hydroxypropanoyl)amino]phenyl]-2-oxo-1H-pyridine-3-carboxylic acid Traditional Name: 6-[4-[(2-acetamido-3-hydroxy-propanoyl)amino]phenyl]-2-keto-1H-pyridine-3-carboxylic acid Formula: C17H17N3O6 MolecularWeight: 359.33338

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CO)C(=O)NC1=CC=C(C=C1)C2=CC=C(C(=O)N2)C(=O)O

Isomeric SMILES

CC(=O)NC(CO)C(=O)NC1=CC=C(C=C1)C2=CC=C(C(=O)N2)C(=O)O

InChI

InChI=1S/C17H17N3O6/c1-9(22)18-14(8-21)16(24)19-11-4-2-10(3-5-11)13-7-6-12(17(25)26)15(23)20-13/h2-7,14,21H,8H2,1H3,(H,18,22)(H,19,24)(H,20,23)(H,25,26)