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

Systemtic Name: 7-chloranyl-3-methoxy-N-methyl-4-oxidanyl-5-phenyl-3H-1,4-benzodiazepin-2-imine Openeye Name: 7-chloro-4-hydroxy-3-methoxy-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-imine CAS Name: 7-chloro-4-hydroxy-3-methoxy-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-imine IUPAC Name: 7-chloro-4-hydroxy-3-methoxy-N-methyl-5-phenyl-3H-1,4-benzodiazepin-2-imine Traditional Name: (7-chloro-4-hydroxy-3-methoxy-5-phenyl-3H-1,4-benzodiazepin-2-ylidene)-methyl-amine Formula: C17H16ClN3O2 MolecularWeight: 329.78084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN=C1C(N(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O)OC

Isomeric SMILES

CN=C1C(N(C(=C2C=C(C=CC2=N1)Cl)C3=CC=CC=C3)O)OC

InChI

InChI=1S/C17H16ClN3O2/c1-19-16-17(23-2)21(22)15(11-6-4-3-5-7-11)13-10-12(18)8-9-14(13)20-16/h3-10,17,22H,1-2H3