7-chloranyl-3-methyl-5-prop-2-ynoxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-3-methyl-5-prop-2-ynoxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Openeye Name: 7-chloro-3-methyl-5-prop-2-ynoxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one CAS Name: 7-chloro-3-methyl-5-prop-2-ynoxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one IUPAC Name: 7-chloro-3-methyl-5-prop-2-ynoxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Traditional Name: 7-chloro-3-methyl-5-propargyloxy-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Formula: C14H12ClF3N2O2 MolecularWeight: 332.70549

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(C2=C(C=CC(=C2)Cl)NC1=O)(C(F)(F)F)OCC#C

Isomeric SMILES

CN1CC(C2=C(C=CC(=C2)Cl)NC1=O)(C(F)(F)F)OCC#C

InChI

InChI=1S/C14H12ClF3N2O2/c1-3-6-22-13(14(16,17)18)8-20(2)12(21)19-11-5-4-9(15)7-10(11)13/h1,4-5,7H,6,8H2,2H3,(H,19,21)