2-[2-[1,6-bis(bromanyl)-4-nitro-cyclohexa-2,4-dien-1-yl]ethyl]-3-phenyl-quinazolin-4-one

Systemtic Name: 2-[2-[1,6-bis(bromanyl)-4-nitro-cyclohexa-2,4-dien-1-yl]ethyl]-3-phenyl-quinazolin-4-one Openeye Name: 2-[2-(1,6-dibromo-4-nitro-cyclohexa-2,4-dien-1-yl)ethyl]-3-phenyl-quinazolin-4-one CAS Name: 2-[2-(1,6-dibromo-4-nitro-1-cyclohexa-2,4-dienyl)ethyl]-3-phenyl-4-quinazolinone IUPAC Name: 2-[2-(1,6-dibromo-4-nitrocyclohexa-2,4-dien-1-yl)ethyl]-3-phenylquinazolin-4-one Traditional Name: 2-[2-(1,6-dibromo-4-nitro-cyclohexa-2,4-dien-1-yl)ethyl]-3-phenyl-quinazolin-4-one Formula: C22H17Br2N3O3 MolecularWeight: 531.19668

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC4(C=CC(=CC4Br)[N+](=O)[O-])Br

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NC3=CC=CC=C3C2=O)CCC4(C=CC(=CC4Br)[N+](=O)[O-])Br

InChI

InChI=1S/C22H17Br2N3O3/c23-19-14-16(27(29)30)10-12-22(19,24)13-11-20-25-18-9-5-4-8-17(18)21(28)26(20)15-6-2-1-3-7-15/h1-10,12,14,19H,11,13H2