5-(2-ethyl-2-methoxycarbonyl-butyl)-2-methoxy-benzoic acid

Systemtic Name: 5-(2-ethyl-2-methoxycarbonyl-butyl)-2-methoxy-benzoic acid Openeye Name: 5-(2-ethyl-2-methoxycarbonyl-butyl)-2-methoxy-benzoic acid CAS Name: 5-(2-ethyl-2-methoxycarbonylbutyl)-2-methoxybenzoic acid IUPAC Name: 5-(2-ethyl-2-methoxycarbonylbutyl)-2-methoxybenzoic acid Traditional Name: 5-(2-carbomethoxy-2-ethyl-butyl)-2-methoxy-benzoic acid Formula: C16H22O5 MolecularWeight: 294.34288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(CC1=CC(=C(C=C1)OC)C(=O)O)C(=O)OC

Isomeric SMILES

CCC(CC)(CC1=CC(=C(C=C1)OC)C(=O)O)C(=O)OC

InChI

InChI=1S/C16H22O5/c1-5-16(6-2,15(19)21-4)10-11-7-8-13(20-3)12(9-11)14(17)18/h7-9H,5-6,10H2,1-4H3,(H,17,18)