3-nitro-6-[[2-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 3-nitro-6-[[2-[2-(6-oxidanylidenecyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 3-nitro-6-[[2-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]hydrazino]methylene]cyclohexa-2,4-dien-1-one CAS Name: 3-nitro-6-[[[2-(6-oxo-1-cyclohexa-2,4-dienylidene)-1H-quinazolin-4-yl]hydrazo]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 3-nitro-6-[[2-[2-(6-oxocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]hydrazinyl]methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-[2-(6-ketocyclohexa-2,4-dien-1-ylidene)-1H-quinazolin-4-yl]hydrazino]methylene]-3-nitro-cyclohexa-2,4-dien-1-one Formula: C21H15N5O4 MolecularWeight: 401.3749

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC(=C3C=CC=CC3=O)N2)NNC=C4C=CC(=CC4=O)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC(=C3C=CC=CC3=O)N2)NNC=C4C=CC(=CC4=O)[N+](=O)[O-]

InChI

InChI=1S/C21H15N5O4/c27-18-8-4-2-6-16(18)20-23-17-7-3-1-5-15(17)21(24-20)25-22-12-13-9-10-14(26(29)30)11-19(13)28/h1-12,22-23H,(H,24,25)