3-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one

Systemtic Name: 3-[(5-bromanyl-3-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Openeye Name: 3-[(5-bromo-3-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one CAS Name: 3-[(5-bromo-3-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]-2-[(2-methylphenoxy)methyl]-4-quinazolinone IUPAC Name: 3-[(5-bromo-3-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Traditional Name: 3-[(5-bromo-6-keto-3-nitro-cyclohexa-2,4-dien-1-ylidene)methylamino]-2-[(2-methylphenoxy)methyl]quinazolin-4-one Formula: C23H17BrN4O5 MolecularWeight: 509.30888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NC3=CC=CC=C3C(=O)N2NC=C4C=C(C=C(C4=O)Br)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1OCC2=NC3=CC=CC=C3C(=O)N2NC=C4C=C(C=C(C4=O)Br)[N+](=O)[O-]

InChI

InChI=1S/C23H17BrN4O5/c1-14-6-2-5-9-20(14)33-13-21-26-19-8-4-3-7-17(19)23(30)27(21)25-12-15-10-16(28(31)32)11-18(24)22(15)29/h2-12,25H,13H2,1H3