[3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 13-(3-chloranyl-4-methoxy-phenyl)tridecanoate

Systemtic Name: [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 13-(3-chloranyl-4-methoxy-phenyl)tridecanoate Openeye Name: [5-isohexyl-3-methoxy-2-(9-methyldecyl)phenyl] 13-(3-chloro-4-methoxy-phenyl)tridecanoate CAS Name: 13-(3-chloro-4-methoxyphenyl)tridecanoic acid [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] ester IUPAC Name: [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 13-(3-chloro-4-methoxyphenyl)tridecanoate Traditional Name: 13-(3-chloro-4-methoxy-phenyl)tridecanoic acid [5-isohexyl-3-methoxy-2-(9-methyldecyl)phenyl] ester Formula: C44H71ClO4 MolecularWeight: 699.48514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCC1=C(C=C(C=C1OC)CCCC(C)C)OC(=O)CCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)CCCCCCCCC1=C(C=C(C=C1OC)CCCC(C)C)OC(=O)CCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C44H71ClO4/c1-35(2)24-19-15-13-14-17-21-28-39-42(48-6)33-38(27-23-25-36(3)4)34-43(39)49-44(46)29-22-18-12-10-8-7-9-11-16-20-26-37-30-31-41(47-5)40(45)32-37/h30-36H,7-29H2,1-6H3