dimethyl 2-[4-methoxy-1-[(E)-2-phenylethenyl]cyclohexa-2,4-dien-1-yl]propanedioate

Systemtic Name: dimethyl 2-[4-methoxy-1-[(E)-2-phenylethenyl]cyclohexa-2,4-dien-1-yl]propanedioate Openeye Name: dimethyl 2-[4-methoxy-1-[(E)-styryl]cyclohexa-2,4-dien-1-yl]propanedioate CAS Name: 2-[4-methoxy-1-[(E)-2-phenylethenyl]-1-cyclohexa-2,4-dienyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[4-methoxy-1-[(E)-2-phenylethenyl]cyclohexa-2,4-dien-1-yl]propanedioate Traditional Name: 2-[4-methoxy-1-[(E)-styryl]cyclohexa-2,4-dien-1-yl]malonic acid dimethyl ester Formula: C20H22O5 MolecularWeight: 342.38568

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CCC(C=C1)(C=CC2=CC=CC=C2)C(C(=O)OC)C(=O)OC

Isomeric SMILES

COC1=CCC(C=C1)(/C=C/C2=CC=CC=C2)C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C20H22O5/c1-23-16-10-13-20(14-11-16,12-9-15-7-5-4-6-8-15)17(18(21)24-2)19(22)25-3/h4-13,17H,14H2,1-3H3/b12-9+