2-(3-methylheptan-3-yloxycarbonyl)benzoic acid

Systemtic Name: 2-(3-methylheptan-3-yloxycarbonyl)benzoic acid Openeye Name: 2-(1-ethyl-1-methyl-pentoxy)carbonylbenzoic acid CAS Name: 2-[3-methylheptan-3-yloxy(oxo)methyl]benzoic acid IUPAC Name: 2-(3-methylheptan-3-yloxycarbonyl)benzoic acid Traditional Name: 2-(1-ethyl-1-methyl-pentoxy)carbonylbenzoic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC)OC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCC(C)(CC)OC(=O)C1=CC=CC=C1C(=O)O

InChI

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