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

Systemtic Name: (3-nitrophenyl) 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (3-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 (3-nitrophenyl) ester IUPAC Name: (3-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 (3-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=CC(=C4)[N+](=O)[O-])C(=O)N2C1

Isomeric SMILES

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

InChI

InChI=1S/C18H13N3O5/c22-17-14-7-6-11(9-15(14)19-16-5-2-8-20(16)17)18(23)26-13-4-1-3-12(10-13)21(24)25/h1,3-4,6-7,9-10H,2,5,8H2