2-pentoxycarbonylbenzoic acid

Systemtic Name: 2-pentoxycarbonylbenzoic acid Openeye Name: 2-pentoxycarbonylbenzoic acid CAS Name: 2-[oxo(pentoxy)methyl]benzoic acid IUPAC Name: 2-pentoxycarbonylbenzoic acid Traditional Name: 2-amoxycarbonylbenzoic acid Formula: C13H16O4 MolecularWeight: 236.26374

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCOC(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C13H16O4/c1-2-3-6-9-17-13(16)11-8-5-4-7-10(11)12(14)15/h4-5,7-8H,2-3,6,9H2,1H3,(H,14,15)