diethyl (2R,4R)-2,4-diethanoyl-3-[4-(7-methyloctoxy)phenyl]pentanedioate

Systemtic Name: diethyl (2R,4R)-2,4-diethanoyl-3-[4-(7-methyloctoxy)phenyl]pentanedioate Openeye Name: diethyl (2R,4R)-2,4-diacetyl-3-[4-(7-methyloctoxy)phenyl]pentanedioate CAS Name: (2R,4R)-2,4-diacetyl-3-[4-(7-methyloctoxy)phenyl]pentanedioic acid diethyl ester IUPAC Name: diethyl (2R,4R)-2,4-diacetyl-3-[4-(7-methyloctoxy)phenyl]pentanedioate Traditional Name: (2R,4R)-2,4-diacetyl-3-[4-(7-methyloctoxy)phenyl]glutaric acid diethyl ester Formula: C28H42O7 MolecularWeight: 490.62888

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=C(C=C1)OCCCCCCC(C)C)C(C(=O)C)C(=O)OCC)C(=O)C

Isomeric SMILES

CCOC(=O)[C@H](C(C1=CC=C(C=C1)OCCCCCCC(C)C)[C@H](C(=O)C)C(=O)OCC)C(=O)C

InChI

InChI=1S/C28H42O7/c1-7-33-27(31)24(20(5)29)26(25(21(6)30)28(32)34-8-2)22-14-16-23(17-15-22)35-18-12-10-9-11-13-19(3)4/h14-17,19,24-26H,7-13,18H2,1-6H3/t24-,25-/m0/s1