[4-(1-methoxy-1-oxidanylidene-propan-2-yl)phenyl] 4-(4-octoxyphenyl)benzoate

Systemtic Name: [4-(1-methoxy-1-oxidanylidene-propan-2-yl)phenyl] 4-(4-octoxyphenyl)benzoate Openeye Name: [4-(2-methoxy-1-methyl-2-oxo-ethyl)phenyl] 4-(4-octoxyphenyl)benzoate CAS Name: 4-(4-octoxyphenyl)benzoic acid [4-(1-methoxy-1-oxopropan-2-yl)phenyl] ester IUPAC Name: [4-(1-methoxy-1-oxopropan-2-yl)phenyl] 4-(4-octoxyphenyl)benzoate Traditional Name: 4-(4-octoxyphenyl)benzoic acid [4-(2-keto-2-methoxy-1-methyl-ethyl)phenyl] ester Formula: C31H36O5 MolecularWeight: 488.61454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(C)C(=O)OC

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC3=CC=C(C=C3)C(C)C(=O)OC

InChI

InChI=1S/C31H36O5/c1-4-5-6-7-8-9-22-35-28-18-16-26(17-19-28)25-10-12-27(13-11-25)31(33)36-29-20-14-24(15-21-29)23(2)30(32)34-3/h10-21,23H,4-9,22H2,1-3H3