(3E)-3-(azanylmethylidene)-7-chloranyl-5-phenyl-4H-1,4-benzodiazepin-2-one

Systemtic Name: (3E)-3-(azanylmethylidene)-7-chloranyl-5-phenyl-4H-1,4-benzodiazepin-2-one Openeye Name: (3E)-3-(aminomethylene)-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one CAS Name: (3E)-3-(aminomethylidene)-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one IUPAC Name: (3E)-3-(aminomethylidene)-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one Traditional Name: (3E)-3-(aminomethylene)-7-chloro-5-phenyl-4H-1,4-benzodiazepin-2-one Formula: C16H12ClN3O MolecularWeight: 297.73898

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)C(=CN)N2)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NC(=O)/C(=C\N)/N2)Cl

InChI

InChI=1S/C16H12ClN3O/c17-11-6-7-13-12(8-11)15(10-4-2-1-3-5-10)19-14(9-18)16(21)20-13/h1-9,19H,18H2/b14-9+