[(1S)-2-oxidanylidenecyclohexyl] (E)-3-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate

Systemtic Name: [(1S)-2-oxidanylidenecyclohexyl] (E)-3-[3-chloranyl-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Openeye Name: [(1S)-2-oxocyclohexyl] (E)-3-(3-chloro-4-isobutoxy-5-methoxy-phenyl)prop-2-enoate CAS Name: (E)-3-[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]-2-propenoic acid [(1S)-2-oxocyclohexyl] ester IUPAC Name: [(1S)-2-oxocyclohexyl] (E)-3-[3-chloro-5-methoxy-4-(2-methylpropoxy)phenyl]prop-2-enoate Traditional Name: (E)-3-(3-chloro-4-isobutoxy-5-methoxy-phenyl)acrylic acid [(1S)-2-ketocyclohexyl] ester Formula: C20H25ClO5 MolecularWeight: 380.8625

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1Cl)C=CC(=O)OC2CCCCC2=O)OC

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1Cl)/C=C/C(=O)O[C@H]2CCCCC2=O)OC

InChI

InChI=1S/C20H25ClO5/c1-13(2)12-25-20-15(21)10-14(11-18(20)24-3)8-9-19(23)26-17-7-5-4-6-16(17)22/h8-11,13,17H,4-7,12H2,1-3H3/b9-8+/t17-/m0/s1