[3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 17-(3-chloranyl-4-methoxy-phenyl)heptadecanoate

Systemtic Name: [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 17-(3-chloranyl-4-methoxy-phenyl)heptadecanoate Openeye Name: [5-isohexyl-3-methoxy-2-(9-methyldecyl)phenyl] 17-(3-chloro-4-methoxy-phenyl)heptadecanoate CAS Name: 17-(3-chloro-4-methoxyphenyl)heptadecanoic acid [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] ester IUPAC Name: [3-methoxy-2-(9-methyldecyl)-5-(4-methylpentyl)phenyl] 17-(3-chloro-4-methoxyphenyl)heptadecanoate Traditional Name: 17-(3-chloro-4-methoxy-phenyl)heptadecanoic acid [5-isohexyl-3-methoxy-2-(9-methyldecyl)phenyl] ester Formula: C48H79ClO4 MolecularWeight: 755.59146

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCCCCCCC1=C(C=C(C=C1OC)CCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

Isomeric SMILES

CC(C)CCCCCCCCC1=C(C=C(C=C1OC)CCCC(C)C)OC(=O)CCCCCCCCCCCCCCCCC2=CC(=C(C=C2)OC)Cl

InChI

InChI=1S/C48H79ClO4/c1-39(2)28-23-19-17-18-21-25-32-43-46(52-6)37-42(31-27-29-40(3)4)38-47(43)53-48(50)33-26-22-16-14-12-10-8-7-9-11-13-15-20-24-30-41-34-35-45(51-5)44(49)36-41/h34-40H,7-33H2,1-6H3