6-heptoxycarbonyl-2,3-di(propan-2-yl)benzoic acid

Systemtic Name: 6-heptoxycarbonyl-2,3-di(propan-2-yl)benzoic acid Openeye Name: 6-heptoxycarbonyl-2,3-diisopropyl-benzoic acid CAS Name: 6-[heptoxy(oxo)methyl]-2,3-di(propan-2-yl)benzoic acid IUPAC Name: 6-heptoxycarbonyl-2,3-di(propan-2-yl)benzoic acid Traditional Name: 6-heptoxycarbonyl-2,3-diisopropyl-benzoic acid Formula: C21H32O4 MolecularWeight: 348.47638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C1=C(C(=C(C=C1)C(C)C)C(C)C)C(=O)O

Isomeric SMILES

CCCCCCCOC(=O)C1=C(C(=C(C=C1)C(C)C)C(C)C)C(=O)O

InChI

InChI=1S/C21H32O4/c1-6-7-8-9-10-13-25-21(24)17-12-11-16(14(2)3)18(15(4)5)19(17)20(22)23/h11-12,14-15H,6-10,13H2,1-5H3,(H,22,23)