(2-decyl-3-methoxy-5-pentyl-phenyl) 13-(3-chloranyl-4-methoxy-phenyl)tridecanoate

Systemtic Name: (2-decyl-3-methoxy-5-pentyl-phenyl) 13-(3-chloranyl-4-methoxy-phenyl)tridecanoate Openeye Name: (2-decyl-3-methoxy-5-pentyl-phenyl) 13-(3-chloro-4-methoxy-phenyl)tridecanoate CAS Name: 13-(3-chloro-4-methoxyphenyl)tridecanoic acid (2-decyl-3-methoxy-5-pentylphenyl) ester IUPAC Name: (2-decyl-3-methoxy-5-pentylphenyl) 13-(3-chloro-4-methoxyphenyl)tridecanoate Traditional Name: 13-(3-chloro-4-methoxy-phenyl)tridecanoic acid (5-amyl-2-decyl-3-methoxy-phenyl) ester Formula: C42H67ClO4 MolecularWeight: 671.43198

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C=C(C=C1OC)CCCCC)OC(=O)CCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CCCCCCCCCCC1=C(C=C(C=C1OC)CCCCC)OC(=O)CCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C42H67ClO4/c1-5-7-9-10-11-17-20-24-28-37-40(46-4)33-36(27-22-8-6-2)34-41(37)47-42(44)29-25-21-18-15-13-12-14-16-19-23-26-35-30-31-39(45-3)38(43)32-35/h30-34H,5-29H2,1-4H3