[4-[4-(4-methylhexyl)phenyl]phenyl] 4-methoxybenzoate

Systemtic Name: [4-[4-(4-methylhexyl)phenyl]phenyl] 4-methoxybenzoate Openeye Name: [4-[4-(4-methylhexyl)phenyl]phenyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [4-[4-(4-methylhexyl)phenyl]phenyl] ester IUPAC Name: [4-[4-(4-methylhexyl)phenyl]phenyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [4-[4-(4-methylhexyl)phenyl]phenyl] ester Formula: C27H30O3 MolecularWeight: 402.5253

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(C)CCCC1=CC=C(C=C1)C2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C27H30O3/c1-4-20(2)6-5-7-21-8-10-22(11-9-21)23-12-18-26(19-13-23)30-27(28)24-14-16-25(29-3)17-15-24/h8-20H,4-7H2,1-3H3