7-chloranyl-N-ethyl-4-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-imine

Systemtic Name: 7-chloranyl-N-ethyl-4-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-imine Openeye Name: 7-chloro-N-ethyl-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-imine CAS Name: 7-chloro-N-ethyl-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-imine IUPAC Name: 7-chloro-N-ethyl-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-imine Traditional Name: (7-chloro-4-hydroxy-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)-ethyl-amine Formula: C17H16ClN3O MolecularWeight: 313.78144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O

Isomeric SMILES

CCN=C1CN(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O

InChI

InChI=1S/C17H16ClN3O/c1-2-19-16-11-21(22)17(12-6-4-3-5-7-12)14-10-13(18)8-9-15(14)20-16/h3-10,22H,2,11H2,1H3