(4-nitrophenyl) 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate

Systemtic Name: (4-nitrophenyl) 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (4-nitrophenyl) 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate CAS Name: 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Traditional Name: 9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (4-nitrophenyl) ester Formula: C18H13N3O5 MolecularWeight: 351.31292

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)OC4=CC=C(C=C4)[N+](=O)[O-])C(=O)N2C1

InChI

InChI=1S/C18H13N3O5/c22-17-14-8-3-11(10-15(14)19-16-2-1-9-20(16)17)18(23)26-13-6-4-12(5-7-13)21(24)25/h3-8,10H,1-2,9H2