methyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylidene-heptanoate

Systemtic Name: methyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylidene-heptanoate Openeye Name: methyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylene-heptanoate CAS Name: 2-[[2-chloro-5-(trifluoromethyl)anilino]-oxomethoxy]-3-methyleneheptanoic acid methyl ester IUPAC Name: methyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylideneheptanoate Traditional Name: 3-butyl-2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]but-3-enoic acid methyl ester Formula: C17H19ClF3NO4 MolecularWeight: 393.78527

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C)C(C(=O)OC)OC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl

Isomeric SMILES

CCCCC(=C)C(C(=O)OC)OC(=O)NC1=C(C=CC(=C1)C(F)(F)F)Cl

InChI

InChI=1S/C17H19ClF3NO4/c1-4-5-6-10(2)14(15(23)25-3)26-16(24)22-13-9-11(17(19,20)21)7-8-12(13)18/h7-9,14H,2,4-6H2,1,3H3,(H,22,24)