ethyl 2-azanyl-6,7-dinitro-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-6,7-dinitro-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-6,7-dinitro-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-6,7-dinitro-1-phenyl-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-6,7-dinitro-1-phenylpyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-6,7-dinitro-1-phenyl-pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C19H14N6O6 MolecularWeight: 422.35106

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC(=C(C=C3N=C12)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC(=C(C=C3N=C12)[N+](=O)[O-])[N+](=O)[O-])C4=CC=CC=C4)N

InChI

InChI=1S/C19H14N6O6/c1-2-31-19(26)15-16-18(23(17(15)20)10-6-4-3-5-7-10)22-12-9-14(25(29)30)13(24(27)28)8-11(12)21-16/h3-9H,2,20H2,1H3