4-[[2,3-bis(oxidanylidene)-4-prop-2-enyl-quinoxalin-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2,3-bis(oxidanylidene)-4-prop-2-enyl-quinoxalin-1-yl]methyl]benzoic acid Openeye Name: 4-[(4-allyl-2,3-dioxo-quinoxalin-1-yl)methyl]benzoic acid CAS Name: 4-[(2,3-dioxo-4-prop-2-enyl-1-quinoxalinyl)methyl]benzoic acid IUPAC Name: 4-[(2,3-dioxo-4-prop-2-enylquinoxalin-1-yl)methyl]benzoic acid Traditional Name: 4-[(4-allyl-2,3-diketo-quinoxalin-1-yl)methyl]benzoic acid Formula: C19H16N2O4 MolecularWeight: 336.34134

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C2=CC=CC=C2N(C(=O)C1=O)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

C=CCN1C2=CC=CC=C2N(C(=O)C1=O)CC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C19H16N2O4/c1-2-11-20-15-5-3-4-6-16(15)21(18(23)17(20)22)12-13-7-9-14(10-8-13)19(24)25/h2-10H,1,11-12H2,(H,24,25)