7-chloranyl-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one Openeye Name: 7-chloro-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one CAS Name: 7-chloro-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one IUPAC Name: 7-chloro-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one Traditional Name: 7-chloro-5-(3-methylphenoxy)-5-(trifluoromethyl)-1H-1,3-benzodiazepin-2-one Formula: C17H12ClF3N2O2 MolecularWeight: 368.73759

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2(C=NC(=O)NC3=C2C=C(C=C3)Cl)C(F)(F)F

Isomeric SMILES

CC1=CC(=CC=C1)OC2(C=NC(=O)NC3=C2C=C(C=C3)Cl)C(F)(F)F

InChI

InChI=1S/C17H12ClF3N2O2/c1-10-3-2-4-12(7-10)25-16(17(19,20)21)9-22-15(24)23-14-6-5-11(18)8-13(14)16/h2-9H,1H3,(H,23,24)