[(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenyl-methyl]carbamic acid

Systemtic Name: [(7-chloranyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenyl-methyl]carbamic acid Openeye Name: [(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenyl-methyl]carbamic acid CAS Name: [(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenylmethyl]carbamic acid IUPAC Name: [(7-chloro-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenylmethyl]carbamic acid Traditional Name: [(7-chloro-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)-phenyl-methyl]carbamic acid Formula: C23H18ClN3O3 MolecularWeight: 419.86032

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)C(C4=CC=CC=C4)NC(=O)O

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Cl)C(=N1)C3=CC=CC=C3)C(C4=CC=CC=C4)NC(=O)O

InChI

InChI=1S/C23H18ClN3O3/c24-17-11-12-19-18(13-17)21(15-7-3-1-4-8-15)25-14-20(28)27(19)22(26-23(29)30)16-9-5-2-6-10-16/h1-13,22,26H,14H2,(H,29,30)