methyl 2-methylidene-6-(4-methylphenyl)-3-oxidanyl-heptanoate

Systemtic Name: methyl 2-methylidene-6-(4-methylphenyl)-3-oxidanyl-heptanoate Openeye Name: methyl 3-hydroxy-2-methylene-6-(p-tolyl)heptanoate CAS Name: 3-hydroxy-2-methylene-6-(4-methylphenyl)heptanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-methylidene-6-(4-methylphenyl)heptanoate Traditional Name: 2-[1-hydroxy-4-(p-tolyl)pentyl]acrylic acid methyl ester Formula: C16H22O3 MolecularWeight: 262.34408

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C)CCC(C(=C)C(=O)OC)O

Isomeric SMILES

CC1=CC=C(C=C1)C(C)CCC(C(=C)C(=O)OC)O

InChI

InChI=1S/C16H22O3/c1-11-5-8-14(9-6-11)12(2)7-10-15(17)13(3)16(18)19-4/h5-6,8-9,12,15,17H,3,7,10H2,1-2,4H3