methyl (E)-3-(hydroxymethyl)-2-methyl-4-phenyl-but-2-enoate

Systemtic Name: methyl (E)-3-(hydroxymethyl)-2-methyl-4-phenyl-but-2-enoate Openeye Name: methyl (E)-3-benzyl-4-hydroxy-2-methyl-but-2-enoate CAS Name: (E)-3-(hydroxymethyl)-2-methyl-4-phenyl-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-benzyl-4-hydroxy-2-methylbut-2-enoate Traditional Name: (E)-3-benzyl-4-hydroxy-2-methyl-but-2-enoic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C/C(=C(/CC1=CC=CC=C1)\CO)/C(=O)OC

InChI

InChI=1S/C13H16O3/c1-10(13(15)16-2)12(9-14)8-11-6-4-3-5-7-11/h3-7,14H,8-9H2,1-2H3/b12-10+