methyl 4-[(Z)-1-(2-acetyloxy-5-methyl-phenyl)-2-(1-oxidanylcyclohexyl)ethenyl]benzoate

Systemtic Name: methyl 4-[(Z)-1-(2-acetyloxy-5-methyl-phenyl)-2-(1-oxidanylcyclohexyl)ethenyl]benzoate Openeye Name: methyl 4-[(Z)-1-(2-acetoxy-5-methyl-phenyl)-2-(1-hydroxycyclohexyl)vinyl]benzoate CAS Name: 4-[(Z)-1-(2-acetyloxy-5-methylphenyl)-2-(1-hydroxycyclohexyl)ethenyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-1-(2-acetyloxy-5-methylphenyl)-2-(1-hydroxycyclohexyl)ethenyl]benzoate Traditional Name: 4-[(Z)-1-(2-acetoxy-5-methyl-phenyl)-2-(1-hydroxycyclohexyl)vinyl]benzoic acid methyl ester Formula: C25H28O5 MolecularWeight: 408.48682

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C)C(=CC2(CCCCC2)O)C3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C)/C(=C\C2(CCCCC2)O)/C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C25H28O5/c1-17-7-12-23(30-18(2)26)21(15-17)22(16-25(28)13-5-4-6-14-25)19-8-10-20(11-9-19)24(27)29-3/h7-12,15-16,28H,4-6,13-14H2,1-3H3/b22-16-