5-(2-azanyl-3-methoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)-2-oxidanyl-benzoic acid

Systemtic Name: 5-(2-azanyl-3-methoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)-2-oxidanyl-benzoic acid Openeye Name: 5-(2-amino-3-methoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)-2-hydroxy-benzoic acid CAS Name: 5-(2-amino-3-methoxycarbonyl-1-pyrrolo[3,2-b]quinoxalinyl)-2-hydroxybenzoic acid IUPAC Name: 5-(2-amino-3-methoxycarbonylpyrrolo[3,2-b]quinoxalin-1-yl)-2-hydroxybenzoic acid Traditional Name: 5-(2-amino-3-carbomethoxy-pyrrolo[3,2-b]quinoxalin-1-yl)-2-hydroxy-benzoic acid Formula: C19H14N4O5 MolecularWeight: 378.33826

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)O)C(=O)O)N

Isomeric SMILES

COC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC(=C(C=C4)O)C(=O)O)N

InChI

InChI=1S/C19H14N4O5/c1-28-19(27)14-15-17(22-12-5-3-2-4-11(12)21-15)23(16(14)20)9-6-7-13(24)10(8-9)18(25)26/h2-8,24H,20H2,1H3,(H,25,26)