[(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-oxidanylbenzoate

Systemtic Name: [(2S)-1-(4-ethylphenyl)-1-oxidanylidene-propan-2-yl] 2-oxidanylbenzoate Openeye Name: [(1S)-2-(4-ethylphenyl)-1-methyl-2-oxo-ethyl] 2-hydroxybenzoate CAS Name: 2-hydroxybenzoic acid [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(4-ethylphenyl)-1-oxopropan-2-yl] 2-hydroxybenzoate Traditional Name: 2-hydroxybenzoic acid [(1S)-2-(4-ethylphenyl)-2-keto-1-methyl-ethyl] ester Formula: C18H18O4 MolecularWeight: 298.33312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)C(C)OC(=O)C2=CC=CC=C2O

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)[C@H](C)OC(=O)C2=CC=CC=C2O

InChI

InChI=1S/C18H18O4/c1-3-13-8-10-14(11-9-13)17(20)12(2)22-18(21)15-6-4-5-7-16(15)19/h4-12,19H,3H2,1-2H3/t12-/m0/s1