3-butan-2-yl-2-oxidanyl-5-(1-phenylethyl)benzoic acid

Systemtic Name: 3-butan-2-yl-2-oxidanyl-5-(1-phenylethyl)benzoic acid Openeye Name: 2-hydroxy-5-(1-phenylethyl)-3-sec-butyl-benzoic acid CAS Name: 3-butan-2-yl-2-hydroxy-5-(1-phenylethyl)benzoic acid IUPAC Name: 3-butan-2-yl-2-hydroxy-5-(1-phenylethyl)benzoic acid Traditional Name: 2-hydroxy-5-(1-phenylethyl)-3-sec-butyl-benzoic acid Formula: C19H22O3 MolecularWeight: 298.37618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C(=CC(=C1)C(C)C2=CC=CC=C2)C(=O)O)O

Isomeric SMILES

CCC(C)C1=C(C(=CC(=C1)C(C)C2=CC=CC=C2)C(=O)O)O

InChI

InChI=1S/C19H22O3/c1-4-12(2)16-10-15(11-17(18(16)20)19(21)22)13(3)14-8-6-5-7-9-14/h5-13,20H,4H2,1-3H3,(H,21,22)