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

Systemtic Name: [4-(4-octoxyphenyl)phenyl] 3-chloranyl-4-heptoxy-benzoate Openeye Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-heptoxy-benzoate CAS Name: 3-chloro-4-heptoxybenzoic acid [4-(4-octoxyphenyl)phenyl] ester IUPAC Name: [4-(4-octoxyphenyl)phenyl] 3-chloro-4-heptoxybenzoate Traditional Name: 3-chloro-4-heptoxy-benzoic acid [4-(4-octoxyphenyl)phenyl] ester Formula: C34H43ClO4 MolecularWeight: 551.15582

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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)OCCCCCCC)Cl

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OCCCCCCC)Cl

InChI

InChI=1S/C34H43ClO4/c1-3-5-7-9-11-12-24-37-30-19-14-27(15-20-30)28-16-21-31(22-17-28)39-34(36)29-18-23-33(32(35)26-29)38-25-13-10-8-6-4-2/h14-23,26H,3-13,24-25H2,1-2H3