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

Systemtic Name: 5-but-2-ynoxy-7-chloranyl-3-methyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Openeye Name: 5-but-2-ynoxy-7-chloro-3-methyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one CAS Name: 5-but-2-ynoxy-7-chloro-3-methyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one IUPAC Name: 5-but-2-ynoxy-7-chloro-3-methyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Traditional Name: 5-but-2-ynoxy-7-chloro-3-methyl-5-(trifluoromethyl)-1,4-dihydro-1,3-benzodiazepin-2-one Formula: C15H14ClF3N2O2 MolecularWeight: 346.73207

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCOC1(CN(C(=O)NC2=C1C=C(C=C2)Cl)C)C(F)(F)F

Isomeric SMILES

CC#CCOC1(CN(C(=O)NC2=C1C=C(C=C2)Cl)C)C(F)(F)F

InChI

InChI=1S/C15H14ClF3N2O2/c1-3-4-7-23-14(15(17,18)19)9-21(2)13(22)20-12-6-5-10(16)8-11(12)14/h5-6,8H,7,9H2,1-2H3,(H,20,22)