methyl (2Z)-3-methyl-3-oxidanyl-2-(phenylmethylidene)pentanoate

Systemtic Name: methyl (2Z)-3-methyl-3-oxidanyl-2-(phenylmethylidene)pentanoate Openeye Name: methyl (2Z)-2-benzylidene-3-hydroxy-3-methyl-pentanoate CAS Name: (2Z)-3-hydroxy-3-methyl-2-(phenylmethylene)pentanoic acid methyl ester IUPAC Name: methyl (2Z)-2-benzylidene-3-hydroxy-3-methylpentanoate Traditional Name: (Z)-2-(1-hydroxy-1-methyl-propyl)-3-phenyl-acrylic acid methyl ester Formula: C14H18O3 MolecularWeight: 234.29092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H18O3/c1-4-14(2,16)12(13(15)17-3)10-11-8-6-5-7-9-11/h5-10,16H,4H2,1-3H3/b12-10+