ethyl 2-azanyl-1-[4-[(3-nitrophenyl)carbonylamino]phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-[4-[(3-nitrophenyl)carbonylamino]phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-[4-[(3-nitrobenzoyl)amino]phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-[4-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-[4-[(3-nitrobenzoyl)amino]phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-[4-[(3-nitrobenzoyl)amino]phenyl]pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C26H20N6O5 MolecularWeight: 496.4742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-])N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC=C(C=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-])N

InChI

InChI=1S/C26H20N6O5/c1-2-37-26(34)21-22-24(30-20-9-4-3-8-19(20)29-22)31(23(21)27)17-12-10-16(11-13-17)28-25(33)15-6-5-7-18(14-15)32(35)36/h3-14H,2,27H2,1H3,(H,28,33)