2,3-bis[[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]methoxy]butanedioic acid

Systemtic Name: 2,3-bis[[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]methoxy]butanedioic acid Openeye Name: 2,3-bis[[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]methoxy]butanedioic acid CAS Name: 2,3-bis[[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]methoxy]butanedioic acid IUPAC Name: 2,3-bis[[4-[3-(4-pentylcyclohexyl)propoxy]phenyl]methoxy]butanedioic acid Traditional Name: 2,3-bis[[4-[3-(4-amylcyclohexyl)propoxy]benzyl]oxy]succinic acid Formula: C46H70O8 MolecularWeight: 751.0432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)COC(C(C(=O)O)OCC3=CC=C(C=C3)OCCCC4CCC(CC4)CCCCC)C(=O)O

Isomeric SMILES

CCCCCC1CCC(CC1)CCCOC2=CC=C(C=C2)COC(C(C(=O)O)OCC3=CC=C(C=C3)OCCCC4CCC(CC4)CCCCC)C(=O)O

InChI

InChI=1S/C46H70O8/c1-3-5-7-11-35-15-19-37(20-16-35)13-9-31-51-41-27-23-39(24-28-41)33-53-43(45(47)48)44(46(49)50)54-34-40-25-29-42(30-26-40)52-32-10-14-38-21-17-36(18-22-38)12-8-6-4-2/h23-30,35-38,43-44H,3-22,31-34H2,1-2H3,(H,47,48)(H,49,50)