2-[[1-[(3-cyanophenyl)methyl]-2-oxidanyl-4-oxidanylidene-quinolin-3-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[1-[(3-cyanophenyl)methyl]-2-oxidanyl-4-oxidanylidene-quinolin-3-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[1-[(3-cyanophenyl)methyl]-2-hydroxy-4-oxo-quinoline-3-carbonyl]amino]acetic acid CAS Name: 2-[[[1-[(3-cyanophenyl)methyl]-2-hydroxy-4-oxo-3-quinolinyl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[1-[(3-cyanophenyl)methyl]-2-hydroxy-4-oxoquinoline-3-carbonyl]amino]acetic acid Traditional Name: 2-[[1-(3-cyanobenzyl)-2-hydroxy-4-keto-quinoline-3-carbonyl]amino]acetic acid Formula: C20H15N3O5 MolecularWeight: 377.3502

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=C(N2CC3=CC=CC(=C3)C#N)O)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=C(N2CC3=CC=CC(=C3)C#N)O)C(=O)NCC(=O)O

InChI

InChI=1S/C20H15N3O5/c21-9-12-4-3-5-13(8-12)11-23-15-7-2-1-6-14(15)18(26)17(20(23)28)19(27)22-10-16(24)25/h1-8,28H,10-11H2,(H,22,27)(H,24,25)