octan-2-yl 4-[[4-(4-methylphenyl)phenoxy]methyl]benzoate

Systemtic Name: octan-2-yl 4-[[4-(4-methylphenyl)phenoxy]methyl]benzoate Openeye Name: 1-methylheptyl 4-[[4-(p-tolyl)phenoxy]methyl]benzoate CAS Name: 4-[[4-(4-methylphenyl)phenoxy]methyl]benzoic acid octan-2-yl ester IUPAC Name: octan-2-yl 4-[[4-(4-methylphenyl)phenoxy]methyl]benzoate Traditional Name: 4-[[4-(p-tolyl)phenoxy]methyl]benzoic acid 1-methylheptyl ester Formula: C29H34O3 MolecularWeight: 430.57846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)COC2=CC=C(C=C2)C3=CC=C(C=C3)C

InChI

InChI=1S/C29H34O3/c1-4-5-6-7-8-23(3)32-29(30)27-15-11-24(12-16-27)21-31-28-19-17-26(18-20-28)25-13-9-22(2)10-14-25/h9-20,23H,4-8,21H2,1-3H3