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

Systemtic Name: [(3-chlorophenyl)-(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)amino] carbamate Openeye Name: (3-chloro-N-(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)anilino) carbamate CAS Name: carbamic acid (3-chloro-N-(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)anilino) ester IUPAC Name: (3-chloro-N-(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)anilino) carbamate Traditional Name: carbamic acid (3-chloro-N-(7-nitro-5-phenyl-3H-1,4-benzodiazepin-2-yl)anilino) ester Formula: C22H16ClN5O4 MolecularWeight: 449.84654

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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)N(C4=CC(=CC=C4)Cl)OC(=O)N

Isomeric SMILES

C1C(=NC2=C(C=C(C=C2)[N+](=O)[O-])C(=N1)C3=CC=CC=C3)N(C4=CC(=CC=C4)Cl)OC(=O)N

InChI

InChI=1S/C22H16ClN5O4/c23-15-7-4-8-16(11-15)27(32-22(24)29)20-13-25-21(14-5-2-1-3-6-14)18-12-17(28(30)31)9-10-19(18)26-20/h1-12H,13H2,(H2,24,29)