[4-(4-octoxycarbonylphenyl)phenyl] 3-methyl-4-octan-2-yloxy-benzoate

Systemtic Name: [4-(4-octoxycarbonylphenyl)phenyl] 3-methyl-4-octan-2-yloxy-benzoate Openeye Name: [4-(4-octoxycarbonylphenyl)phenyl] 3-methyl-4-(1-methylheptoxy)benzoate CAS Name: 3-methyl-4-octan-2-yloxybenzoic acid [4-[4-[octoxy(oxo)methyl]phenyl]phenyl] ester IUPAC Name: [4-(4-octoxycarbonylphenyl)phenyl] 3-methyl-4-octan-2-yloxybenzoate Traditional Name: 3-methyl-4-(1-methylheptoxy)benzoic acid [4-(4-octoxycarbonylphenyl)phenyl] ester Formula: C37H48O5 MolecularWeight: 572.77402

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OC(C)CCCCCC)C

Isomeric SMILES

CCCCCCCCOC(=O)C1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC(=C(C=C3)OC(C)CCCCCC)C

InChI

InChI=1S/C37H48O5/c1-5-7-9-11-12-14-26-40-36(38)32-18-16-30(17-19-32)31-20-23-34(24-21-31)42-37(39)33-22-25-35(28(3)27-33)41-29(4)15-13-10-8-6-2/h16-25,27,29H,5-15,26H2,1-4H3