2-[[8-(cyclohexen-1-yl)-6-oxidanylidene-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid

Systemtic Name: 2-[[8-(cyclohexen-1-yl)-6-oxidanylidene-4H-quinoxalin-5-yl]carbonylamino]ethanoic acid Openeye Name: 2-[[8-(cyclohexen-1-yl)-6-oxo-4H-quinoxaline-5-carbonyl]amino]acetic acid CAS Name: 2-[[[8-(1-cyclohexenyl)-6-oxo-4H-quinoxalin-5-yl]-oxomethyl]amino]acetic acid IUPAC Name: 2-[[8-(cyclohexen-1-yl)-6-oxo-4H-quinoxaline-5-carbonyl]amino]acetic acid Traditional Name: 2-[[8-(cyclohexen-1-yl)-6-keto-4H-quinoxaline-5-carbonyl]amino]acetic acid Formula: C17H17N3O4 MolecularWeight: 327.33458

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C2=CC(=O)C(=C3C2=NC=CN3)C(=O)NCC(=O)O

Isomeric SMILES

C1CCC(=CC1)C2=CC(=O)C(=C3C2=NC=CN3)C(=O)NCC(=O)O

InChI

InChI=1S/C17H17N3O4/c21-12-8-11(10-4-2-1-3-5-10)15-16(19-7-6-18-15)14(12)17(24)20-9-13(22)23/h4,6-8,19H,1-3,5,9H2,(H,20,24)(H,22,23)