2-butoxycarbonyl-6-butyl-benzoic acid

Systemtic Name: 2-butoxycarbonyl-6-butyl-benzoic acid Openeye Name: 2-butoxycarbonyl-6-butyl-benzoic acid CAS Name: 2-[butoxy(oxo)methyl]-6-butylbenzoic acid IUPAC Name: 2-butoxycarbonyl-6-butylbenzoic acid Traditional Name: 2-butoxycarbonyl-6-butyl-benzoic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=CC(=C1C(=O)O)C(=O)OCCCC

Isomeric SMILES

CCCCC1=CC=CC(=C1C(=O)O)C(=O)OCCCC

InChI

InChI=1S/C16H22O4/c1-3-5-8-12-9-7-10-13(14(12)15(17)18)16(19)20-11-6-4-2/h7,9-10H,3-6,8,11H2,1-2H3,(H,17,18)