dipropan-2-yl 4-cyano-4-(3,5-dimethoxyphenyl)heptanedioate

Systemtic Name: dipropan-2-yl 4-cyano-4-(3,5-dimethoxyphenyl)heptanedioate Openeye Name: diisopropyl 4-cyano-4-(3,5-dimethoxyphenyl)heptanedioate CAS Name: 4-cyano-4-(3,5-dimethoxyphenyl)heptanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 4-cyano-4-(3,5-dimethoxyphenyl)heptanedioate Traditional Name: 4-cyano-4-(3,5-dimethoxyphenyl)pimelic acid diisopropyl ester Formula: C22H31NO6 MolecularWeight: 405.48464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)CCC(CCC(=O)OC(C)C)(C#N)C1=CC(=CC(=C1)OC)OC

Isomeric SMILES

CC(C)OC(=O)CCC(CCC(=O)OC(C)C)(C#N)C1=CC(=CC(=C1)OC)OC

InChI

InChI=1S/C22H31NO6/c1-15(2)28-20(24)7-9-22(14-23,10-8-21(25)29-16(3)4)17-11-18(26-5)13-19(12-17)27-6/h11-13,15-16H,7-10H2,1-6H3