3-[(3-chloranyl-5-ethoxy-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-chloranyl-5-ethoxy-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-chloro-5-ethoxy-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-chloro-5-ethoxy-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-chloro-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Traditional Name: 3-[(3-chloro-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-7-nitro-2,4-dihydro-1H-pyrrolo[2,1-b]quinazolin-9-one Formula: C20H16ClN3O5 MolecularWeight: 413.81114

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC2=C3NC4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CC2)C=C(C1=O)Cl

Isomeric SMILES

CCOC1=CC(=CC2=C3NC4=C(C=C(C=C4)[N+](=O)[O-])C(=O)N3CC2)C=C(C1=O)Cl

InChI

InChI=1S/C20H16ClN3O5/c1-2-29-17-9-11(8-15(21)18(17)25)7-12-5-6-23-19(12)22-16-4-3-13(24(27)28)10-14(16)20(23)26/h3-4,7-10,22H,2,5-6H2,1H3