methyl 3-(4-ethylphenyl)-2-oxidanyl-but-3-enoate

Systemtic Name: methyl 3-(4-ethylphenyl)-2-oxidanyl-but-3-enoate Openeye Name: methyl 3-(4-ethylphenyl)-2-hydroxy-but-3-enoate CAS Name: 3-(4-ethylphenyl)-2-hydroxy-3-butenoic acid methyl ester IUPAC Name: methyl 3-(4-ethylphenyl)-2-hydroxybut-3-enoate Traditional Name: 3-(4-ethylphenyl)-2-hydroxy-but-3-enoic acid methyl ester Formula: C13H16O3 MolecularWeight: 220.26434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=C)C(C(=O)OC)O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=C)C(C(=O)OC)O

InChI

InChI=1S/C13H16O3/c1-4-10-5-7-11(8-6-10)9(2)12(14)13(15)16-3/h5-8,12,14H,2,4H2,1,3H3