dimethyl (2E,4Z)-3-(2-phenylpropanoyl)hexa-2,4-dienedioate

Systemtic Name: dimethyl (2E,4Z)-3-(2-phenylpropanoyl)hexa-2,4-dienedioate Openeye Name: dimethyl (2E,4Z)-3-(2-phenylpropanoyl)hexa-2,4-dienedioate CAS Name: (2E,4Z)-3-(1-oxo-2-phenylpropyl)hexa-2,4-dienedioic acid dimethyl ester IUPAC Name: dimethyl (2E,4Z)-3-(2-phenylpropanoyl)hexa-2,4-dienedioate Traditional Name: (2E,4Z)-3-hydratropoylmuconic acid dimethyl ester Formula: C17H18O5 MolecularWeight: 302.32182

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18O5/c1-12(13-7-5-4-6-8-13)17(20)14(11-16(19)22-3)9-10-15(18)21-2/h4-12H,1-3H3/b10-9-,14-11+