[4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-(4-heptylcyclohexyl)benzoate

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-(4-heptylcyclohexyl)benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-heptylcyclohexyl)benzoate CAS Name: 3-chloro-4-(4-heptylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-(4-heptylcyclohexyl)benzoate Traditional Name: 3-chloro-4-(4-heptylcyclohexyl)benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C40H53ClO3 MolecularWeight: 617.30002

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCCC)Cl

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)C4CCC(CC4)CCCCCCC)Cl

InChI

InChI=1S/C40H53ClO3/c1-3-5-7-9-11-13-29-43-36-24-19-32(20-25-36)33-21-26-37(27-22-33)44-40(42)35-23-28-38(39(41)30-35)34-17-15-31(16-18-34)14-12-10-8-6-4-2/h19-28,30-31,34H,3-18,29H2,1-2H3