methyl (E)-2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methyl-hept-3-enoate

Systemtic Name: methyl (E)-2-[[2-chloranyl-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methyl-hept-3-enoate Openeye Name: methyl (E)-2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methyl-hept-3-enoate CAS Name: (E)-2-[[2-chloro-5-(trifluoromethyl)anilino]-oxomethoxy]-3-methyl-3-heptenoic acid methyl ester IUPAC Name: methyl (E)-2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methylhept-3-enoate Traditional Name: (E)-2-[[2-chloro-5-(trifluoromethyl)phenyl]carbamoyloxy]-3-methyl-hept-3-enoic acid methyl ester Formula: C17H19ClF3NO4 MolecularWeight: 393.78527

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC/C=C(\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/h6-9,14H,4-5H2,1-3H3,(H,22,24)/b10-6+