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

Systemtic Name: 3-(2-azanyl-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)benzoic acid Openeye Name: 3-(2-amino-3-ethoxycarbonyl-pyrrolo[3,2-b]quinoxalin-1-yl)benzoic acid CAS Name: 3-(2-amino-3-ethoxycarbonyl-1-pyrrolo[3,2-b]quinoxalinyl)benzoic acid IUPAC Name: 3-(2-amino-3-ethoxycarbonylpyrrolo[3,2-b]quinoxalin-1-yl)benzoic acid Traditional Name: 3-(2-amino-3-carbethoxy-pyrrolo[3,2-b]quinoxalin-1-yl)benzoic acid Formula: C20H16N4O4 MolecularWeight: 376.36544

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16N4O4/c1-2-28-20(27)15-16-18(23-14-9-4-3-8-13(14)22-16)24(17(15)21)12-7-5-6-11(10-12)19(25)26/h3-10H,2,21H2,1H3,(H,25,26)