7-chloranyl-3-methyl-5-pentyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one

Systemtic Name: 7-chloranyl-3-methyl-5-pentyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Openeye Name: 7-chloro-3-methyl-5-pentyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one CAS Name: 7-chloro-3-methyl-5-pentyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one IUPAC Name: 7-chloro-3-methyl-5-pentyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Traditional Name: 5-amyl-7-chloro-3-methyl-5-(trifluoromethyl)-1H-1,4-benzodiazepin-2-one Formula: C16H18ClF3N2O MolecularWeight: 346.77513

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)C(=N1)C)C(F)(F)F

Isomeric SMILES

CCCCCC1(C2=C(C=CC(=C2)Cl)NC(=O)C(=N1)C)C(F)(F)F

InChI

InChI=1S/C16H18ClF3N2O/c1-3-4-5-8-15(16(18,19)20)12-9-11(17)6-7-13(12)21-14(23)10(2)22-15/h6-7,9H,3-5,8H2,1-2H3,(H,21,23)