[(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(3-bromophenyl)carbamate

Systemtic Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(3-bromophenyl)carbamate Openeye Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(3-bromophenyl)carbamate CAS Name: N-(3-bromophenyl)carbamic acid [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester IUPAC Name: [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] N-(3-bromophenyl)carbamate Traditional Name: N-(3-bromophenyl)carbamic acid [(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] ester Formula: C22H16BrN5O4 MolecularWeight: 494.29754

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)NOC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)NOC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C22H16BrN5O4/c23-15-7-4-8-16(11-15)25-22(29)32-27-20-13-24-21(14-5-2-1-3-6-14)18-12-17(28(30)31)9-10-19(18)26-20/h1-12H,13H2,(H,25,29)(H,26,27)