7-chloranyl-5-(2-chlorophenyl)-N-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine

Systemtic Name: 7-chloranyl-5-(2-chlorophenyl)-N-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine Openeye Name: 7-chloro-5-(2-chlorophenyl)-N-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine CAS Name: 7-chloro-5-(2-chlorophenyl)-N-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine IUPAC Name: 7-chloro-5-(2-chlorophenyl)-N-(4-methoxyphenyl)-3H-1,4-benzodiazepin-2-amine Traditional Name: [7-chloro-5-(2-chlorophenyl)-3H-1,4-benzodiazepin-2-yl]-(4-methoxyphenyl)amine Formula: C22H17Cl2N3O MolecularWeight: 410.29588

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NC3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl

InChI

InChI=1S/C22H17Cl2N3O/c1-28-16-9-7-15(8-10-16)26-21-13-25-22(17-4-2-3-5-19(17)24)18-12-14(23)6-11-20(18)27-21/h2-12H,13H2,1H3,(H,26,27)