dipropan-2-yl 4-(2-chloranyl-5-methoxy-phenyl)-4-cyano-heptanedioate

Systemtic Name: dipropan-2-yl 4-(2-chloranyl-5-methoxy-phenyl)-4-cyano-heptanedioate Openeye Name: diisopropyl 4-(2-chloro-5-methoxy-phenyl)-4-cyano-heptanedioate CAS Name: 4-(2-chloro-5-methoxyphenyl)-4-cyanoheptanedioic acid dipropan-2-yl ester IUPAC Name: dipropan-2-yl 4-(2-chloro-5-methoxyphenyl)-4-cyanoheptanedioate Traditional Name: 4-(2-chloro-5-methoxy-phenyl)-4-cyano-pimelic acid diisopropyl ester Formula: C21H28ClNO5 MolecularWeight: 409.90372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H28ClNO5/c1-14(2)27-19(24)8-10-21(13-23,11-9-20(25)28-15(3)4)17-12-16(26-5)6-7-18(17)22/h6-7,12,14-15H,8-11H2,1-5H3