1-(3-bromophenyl)-2-pyridin-3-yl-1H-benzo[g][1,4]benzoxazepine-3,4-dione

Systemtic Name: 1-(3-bromophenyl)-2-pyridin-3-yl-1H-benzo[g][1,4]benzoxazepine-3,4-dione Openeye Name: 1-(3-bromophenyl)-2-(3-pyridyl)-1H-benzo[g][1,4]benzoxazepine-3,4-dione CAS Name: 1-(3-bromophenyl)-2-(3-pyridinyl)-1H-benzo[g][1,4]benzoxazepine-3,4-dione IUPAC Name: 1-(3-bromophenyl)-2-pyridin-3-yl-1H-benzo[g][1,4]benzoxazepine-3,4-dione Traditional Name: 1-(3-bromophenyl)-2-(3-pyridyl)-1H-benzo[g][1,4]benzoxazepine-3,4-quinone Formula: C24H15BrN2O3 MolecularWeight: 459.2915

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC3=C2C(N(C(=O)C(=O)O3)C4=CN=CC=C4)C5=CC(=CC=C5)Br

Isomeric SMILES

C1=CC=C2C(=C1)C=CC3=C2C(N(C(=O)C(=O)O3)C4=CN=CC=C4)C5=CC(=CC=C5)Br

InChI

InChI=1S/C24H15BrN2O3/c25-17-7-3-6-16(13-17)22-21-19-9-2-1-5-15(19)10-11-20(21)30-24(29)23(28)27(22)18-8-4-12-26-14-18/h1-14,22H