didodecyl 2-[(5-cyanocyclohexa-1,5-dien-1-yl)methylidene]propanedioate

Systemtic Name: didodecyl 2-[(5-cyanocyclohexa-1,5-dien-1-yl)methylidene]propanedioate Openeye Name: didodecyl 2-[(5-cyanocyclohexa-1,5-dien-1-yl)methylene]propanedioate CAS Name: 2-[(5-cyano-1-cyclohexa-1,5-dienyl)methylidene]propanedioic acid didodecyl ester IUPAC Name: didodecyl 2-[(5-cyanocyclohexa-1,5-dien-1-yl)methylidene]propanedioate Traditional Name: 2-[(5-cyanocyclohexa-1,5-dien-1-yl)methylene]malonic acid dilauryl ester Formula: C35H57NO4 MolecularWeight: 555.83138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)C(=CC1=CCCC(=C1)C#N)C(=O)OCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCOC(=O)C(=CC1=CCCC(=C1)C#N)C(=O)OCCCCCCCCCCCC

InChI

InChI=1S/C35H57NO4/c1-3-5-7-9-11-13-15-17-19-21-26-39-34(37)33(29-31-24-23-25-32(28-31)30-36)35(38)40-27-22-20-18-16-14-12-10-8-6-4-2/h24,28-29H,3-23,25-27H2,1-2H3