[3-chloranyl-4-(4-octylphenyl)carbonyloxy-phenyl] 4-heptylbenzoate

Systemtic Name: [3-chloranyl-4-(4-octylphenyl)carbonyloxy-phenyl] 4-heptylbenzoate Openeye Name: [3-chloro-4-(4-octylbenzoyl)oxy-phenyl] 4-heptylbenzoate CAS Name: 4-heptylbenzoic acid [3-chloro-4-[(4-octylphenyl)-oxomethoxy]phenyl] ester IUPAC Name: [3-chloro-4-(4-octylbenzoyl)oxyphenyl] 4-heptylbenzoate Traditional Name: 4-heptylbenzoic acid [3-chloro-4-(4-octylbenzoyl)oxy-phenyl] ester Formula: C35H43ClO4 MolecularWeight: 563.16652

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCC)Cl

Isomeric SMILES

CCCCCCCCC1=CC=C(C=C1)C(=O)OC2=C(C=C(C=C2)OC(=O)C3=CC=C(C=C3)CCCCCCC)Cl

InChI

InChI=1S/C35H43ClO4/c1-3-5-7-9-11-13-15-28-18-22-30(23-19-28)35(38)40-33-25-24-31(26-32(33)36)39-34(37)29-20-16-27(17-21-29)14-12-10-8-6-4-2/h16-26H,3-15H2,1-2H3