(2E)-2-(7-chloranyl-4-oxidanylidene-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitroso-ethanoic acid

Systemtic Name: (2E)-2-(7-chloranyl-4-oxidanylidene-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitroso-ethanoic acid Openeye Name: (2E)-2-(7-chloro-4-oxo-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitroso-acetic acid CAS Name: (2E)-2-(7-chloro-4-oxo-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitrosoacetic acid IUPAC Name: (2E)-2-(7-chloro-4-oxo-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitrosoacetic acid Traditional Name: (2E)-2-(7-chloro-4-keto-5-phenyl-1H-1,5-benzodiazepin-2-ylidene)-2-nitroso-acetic acid Formula: C17H12ClN3O4 MolecularWeight: 357.74788

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=C(C(=O)O)N=O)NC2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3

Isomeric SMILES

C1/C(=C(/C(=O)O)\N=O)/NC2=C(C=C(C=C2)Cl)N(C1=O)C3=CC=CC=C3

InChI

InChI=1S/C17H12ClN3O4/c18-10-6-7-12-14(8-10)21(11-4-2-1-3-5-11)15(22)9-13(19-12)16(20-25)17(23)24/h1-8,19H,9H2,(H,23,24)/b16-13+