4-octan-2-yloxycarbonylbenzoic acid

Systemtic Name: 4-octan-2-yloxycarbonylbenzoic acid Openeye Name: 4-(1-methylheptoxycarbonyl)benzoic acid CAS Name: 4-[octan-2-yloxy(oxo)methyl]benzoic acid IUPAC Name: 4-octan-2-yloxycarbonylbenzoic acid Traditional Name: 4-(1-methylheptoxycarbonyl)benzoic acid Formula: C16H22O4 MolecularWeight: 278.34348

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CCCCCCC(C)OC(=O)C1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C16H22O4/c1-3-4-5-6-7-12(2)20-16(19)14-10-8-13(9-11-14)15(17)18/h8-12H,3-7H2,1-2H3,(H,17,18)