dimethyl (2E,6E)-4-oxidanylidene-2,6-bis(phenylmethylidene)heptanedioate

Systemtic Name: dimethyl (2E,6E)-4-oxidanylidene-2,6-bis(phenylmethylidene)heptanedioate Openeye Name: dimethyl (2E,6E)-2,6-dibenzylidene-4-oxo-heptanedioate CAS Name: (2E,6E)-4-oxo-2,6-bis(phenylmethylene)heptanedioic acid dimethyl ester IUPAC Name: dimethyl (2E,6E)-2,6-dibenzylidene-4-oxoheptanedioate Traditional Name: (2E,6E)-2,6-dibenzal-4-keto-pimelic acid dimethyl ester Formula: C23H22O5 MolecularWeight: 378.41778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC(=O)/C(=C/C1=CC=CC=C1)/CC(=O)C/C(=C\C2=CC=CC=C2)/C(=O)OC

InChI

InChI=1S/C23H22O5/c1-27-22(25)19(13-17-9-5-3-6-10-17)15-21(24)16-20(23(26)28-2)14-18-11-7-4-8-12-18/h3-14H,15-16H2,1-2H3/b19-13+,20-14+