methyl 2-[3-(3-methanoylphenyl)-6-methoxy-6-oxidanylidene-hexyl]benzoate

Systemtic Name: methyl 2-[3-(3-methanoylphenyl)-6-methoxy-6-oxidanylidene-hexyl]benzoate Openeye Name: methyl 2-[3-(3-formylphenyl)-6-methoxy-6-oxo-hexyl]benzoate CAS Name: 2-[3-(3-formylphenyl)-6-methoxy-6-oxohexyl]benzoic acid methyl ester IUPAC Name: methyl 2-[3-(3-formylphenyl)-6-methoxy-6-oxohexyl]benzoate Traditional Name: 2-[3-(3-formylphenyl)-6-keto-6-methoxy-hexyl]benzoic acid methyl ester Formula: C22H24O5 MolecularWeight: 368.42296

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(CCC1=CC=CC=C1C(=O)OC)C2=CC=CC(=C2)C=O

Isomeric SMILES

COC(=O)CCC(CCC1=CC=CC=C1C(=O)OC)C2=CC=CC(=C2)C=O

InChI

InChI=1S/C22H24O5/c1-26-21(24)13-12-17(19-8-5-6-16(14-19)15-23)10-11-18-7-3-4-9-20(18)22(25)27-2/h3-9,14-15,17H,10-13H2,1-2H3