3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine

Systemtic Name: 3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine Openeye Name: 3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine CAS Name: 3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine IUPAC Name: 3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine Traditional Name: 3-(4-bromophenyl)-5-methoxy-7-nitro-2H-1,2,4-benzoxadiazine Formula: C14H10BrN3O4 MolecularWeight: 364.1509

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1N=C(NO2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=CC(=CC2=C1N=C(NO2)C3=CC=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C14H10BrN3O4/c1-21-11-6-10(18(19)20)7-12-13(11)16-14(17-22-12)8-2-4-9(15)5-3-8/h2-7H,1H3,(H,16,17)