3-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one

Systemtic Name: 3-[(3,5-dimethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Openeye Name: 3-[(3,5-dimethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one CAS Name: 3-[(3,5-dimethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one IUPAC Name: 3-[(3,5-dimethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Traditional Name: 3-[(4-keto-3,5-dimethoxy-cyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Formula: C20H17N3O6 MolecularWeight: 395.36548

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C3NC4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CC2)C=C(C1=O)OC

Isomeric SMILES

COC1=CC(=CC2=C3NC4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CC2)C=C(C1=O)OC

InChI

InChI=1S/C20H17N3O6/c1-28-16-8-11(9-17(29-2)18(16)24)7-12-5-6-22-19(12)21-15-4-3-13(23(26)27)10-14(15)20(22)25/h3-4,7-10,21H,5-6H2,1-2H3