dimethyl 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)heptanedioate

Systemtic Name: dimethyl 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)heptanedioate Openeye Name: dimethyl 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)heptanedioate CAS Name: 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)heptanedioic acid dimethyl ester IUPAC Name: dimethyl 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)heptanedioate Traditional Name: 4-cyano-4-(7-methoxy-2,2-dimethyl-1,3-benzodioxol-4-yl)pimelic acid dimethyl ester Formula: C20H25NO7 MolecularWeight: 391.415

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OC2=C(C=CC(=C2O1)OC)C(CCC(=O)OC)(CCC(=O)OC)C#N)C

Isomeric SMILES

CC1(OC2=C(C=CC(=C2O1)OC)C(CCC(=O)OC)(CCC(=O)OC)C#N)C

InChI

InChI=1S/C20H25NO7/c1-19(2)27-17-13(6-7-14(24-3)18(17)28-19)20(12-21,10-8-15(22)25-4)11-9-16(23)26-5/h6-7H,8-11H2,1-5H3