2-[[6-oxidanylidene-2-(3-propan-2-yloxyphenyl)-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[6-oxidanylidene-2-(3-propan-2-yloxyphenyl)-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[2-(3-isopropoxyphenyl)-6-oxo-4H-quinoxaline-5-carbonyl]amino]acetic acid CAS Name: 2-[[oxo-[6-oxo-2-(3-propan-2-yloxyphenyl)-4H-quinoxalin-5-yl]methyl]amino]acetic acid IUPAC Name: 2-[[6-oxo-2-(3-propan-2-yloxyphenyl)-4H-quinoxaline-5-carbonyl]amino]acetic acid Traditional Name: 2-[[2-(3-isopropoxyphenyl)-6-keto-4H-quinoxaline-5-carbonyl]amino]acetic acid Formula: C20H19N3O5 MolecularWeight: 381.38196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C2=CNC3=C(C(=O)C=CC3=N2)C(=O)NCC(=O)O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C2=CNC3=C(C(=O)C=CC3=N2)C(=O)NCC(=O)O

InChI

InChI=1S/C20H19N3O5/c1-11(2)28-13-5-3-4-12(8-13)15-9-21-19-14(23-15)6-7-16(24)18(19)20(27)22-10-17(25)26/h3-9,11,21H,10H2,1-2H3,(H,22,27)(H,25,26)