dimethyl 2,2-bis[(E)-3-(3-methylphenyl)prop-2-enyl]propanedioate

Systemtic Name: dimethyl 2,2-bis[(E)-3-(3-methylphenyl)prop-2-enyl]propanedioate Openeye Name: dimethyl 2,2-bis[(E)-3-(m-tolyl)allyl]propanedioate CAS Name: 2,2-bis[(E)-3-(3-methylphenyl)prop-2-enyl]propanedioic acid dimethyl ester IUPAC Name: dimethyl 2,2-bis[(E)-3-(3-methylphenyl)prop-2-enyl]propanedioate Traditional Name: 2,2-bis[(E)-3-(m-tolyl)allyl]malonic acid dimethyl ester Formula: C25H28O4 MolecularWeight: 392.48742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C=CCC(CC=CC2=CC(=CC=C2)C)(C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC=CC(=C1)/C=C/CC(C(=O)OC)(C(=O)OC)C/C=C/C2=CC(=CC=C2)C

InChI

InChI=1S/C25H28O4/c1-19-9-5-11-21(17-19)13-7-15-25(23(26)28-3,24(27)29-4)16-8-14-22-12-6-10-20(2)18-22/h5-14,17-18H,15-16H2,1-4H3/b13-7+,14-8+