[4-(hydroxymethyl)-4-oxidanyl-3-bicyclo[3.1.0]hexanyl]methyl benzoate

Systemtic Name: [4-(hydroxymethyl)-4-oxidanyl-3-bicyclo[3.1.0]hexanyl]methyl benzoate Openeye Name: [4-hydroxy-4-(hydroxymethyl)-3-bicyclo[3.1.0]hexanyl]methyl benzoate CAS Name: benzoic acid [4-hydroxy-4-(hydroxymethyl)-3-bicyclo[3.1.0]hexanyl]methyl ester IUPAC Name: [4-hydroxy-4-(hydroxymethyl)-3-bicyclo[3.1.0]hexanyl]methyl benzoate Traditional Name: benzoic acid (4-hydroxy-4-methylol-3-bicyclo[3.1.0]hexanyl)methyl ester Formula: C15H18O4 MolecularWeight: 262.30102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC2C(C1COC(=O)C3=CC=CC=C3)(CO)O

Isomeric SMILES

C1C2CC2C(C1COC(=O)C3=CC=CC=C3)(CO)O

InChI

InChI=1S/C15H18O4/c16-9-15(18)12(6-11-7-13(11)15)8-19-14(17)10-4-2-1-3-5-10/h1-5,11-13,16,18H,6-9H2