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

Systemtic Name: 2-methylpropyl 2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylidene-heptanoate Openeye Name: isobutyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylene-heptanoate CAS Name: 2-[[2-chloro-5-(trifluoromethyl)anilino]-oxomethoxy]-3-methyleneheptanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylideneheptanoate Traditional Name: 3-butyl-2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]but-3-enoic acid isobutyl ester Formula: C20H25ClF3NO4 MolecularWeight: 435.86501

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25ClF3NO4/c1-5-6-7-13(4)17(18(26)28-11-12(2)3)29-19(27)25-16-10-14(20(22,23)24)8-9-15(16)21/h8-10,12,17H,4-7,11H2,1-3H3,(H,25,27)