methyl (E)-3-[4-(2-oxidanylidenepropyl)phenyl]but-2-enoate

Systemtic Name: methyl (E)-3-[4-(2-oxidanylidenepropyl)phenyl]but-2-enoate Openeye Name: methyl (E)-3-(4-acetonylphenyl)but-2-enoate CAS Name: (E)-3-[4-(2-oxopropyl)phenyl]-2-butenoic acid methyl ester IUPAC Name: methyl (E)-3-[4-(2-oxopropyl)phenyl]but-2-enoate Traditional Name: (E)-3-(4-acetonylphenyl)but-2-enoic acid methyl ester Formula: C14H16O3 MolecularWeight: 232.27504

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H16O3/c1-10(8-14(16)17-3)13-6-4-12(5-7-13)9-11(2)15/h4-8H,9H2,1-3H3/b10-8+