7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one

Systemtic Name: 7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Openeye Name: 7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one CAS Name: 7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one IUPAC Name: 7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Traditional Name: 7,8-dimethoxy-1-propyl-5-[3-(trifluoromethyl)phenyl]-3H-1,4-benzodiazepin-2-one Formula: C21H21F3N2O3 MolecularWeight: 406.39825

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)CN=C(C2=CC(=C(C=C21)OC)OC)C3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

CCCN1C(=O)CN=C(C2=CC(=C(C=C21)OC)OC)C3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C21H21F3N2O3/c1-4-8-26-16-11-18(29-3)17(28-2)10-15(16)20(25-12-19(26)27)13-6-5-7-14(9-13)21(22,23)24/h5-7,9-11H,4,8,12H2,1-3H3