methyl (E)-2-(2-phenylethanoyl)but-2-enoate

Systemtic Name: methyl (E)-2-(2-phenylethanoyl)but-2-enoate Openeye Name: methyl (E)-2-(2-phenylacetyl)but-2-enoate CAS Name: (E)-2-(1-oxo-2-phenylethyl)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-2-(2-phenylacetyl)but-2-enoate Traditional Name: (E)-2-(2-phenylacetyl)but-2-enoic acid methyl ester Formula: C13H14O3 MolecularWeight: 218.24846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H14O3/c1-3-11(13(15)16-2)12(14)9-10-7-5-4-6-8-10/h3-8H,9H2,1-2H3/b11-3+