[3-methyl-4-[2-(4-methyl-4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]phenyl] 2-methylbenzoate

Systemtic Name: [3-methyl-4-[2-(4-methyl-4-oxidanyl-6-oxidanylidene-oxan-2-yl)ethyl]phenyl] 2-methylbenzoate Openeye Name: [4-[2-(4-hydroxy-4-methyl-6-oxo-tetrahydropyran-2-yl)ethyl]-3-methyl-phenyl] 2-methylbenzoate CAS Name: 2-methylbenzoic acid [4-[2-(4-hydroxy-4-methyl-6-oxo-2-oxanyl)ethyl]-3-methylphenyl] ester IUPAC Name: [4-[2-(4-hydroxy-4-methyl-6-oxooxan-2-yl)ethyl]-3-methylphenyl] 2-methylbenzoate Traditional Name: 2-methylbenzoic acid [4-[2-(4-hydroxy-6-keto-4-methyl-tetrahydropyran-2-yl)ethyl]-3-methyl-phenyl] ester Formula: C23H26O5 MolecularWeight: 382.44954

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)OC2=CC(=C(C=C2)CCC3CC(CC(=O)O3)(C)O)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)OC2=CC(=C(C=C2)CCC3CC(CC(=O)O3)(C)O)C

InChI

InChI=1S/C23H26O5/c1-15-6-4-5-7-20(15)22(25)28-18-10-8-17(16(2)12-18)9-11-19-13-23(3,26)14-21(24)27-19/h4-8,10,12,19,26H,9,11,13-14H2,1-3H3