3-decyl-4-(3-methylbutoxycarbonyl)benzoate

Systemtic Name: 3-decyl-4-(3-methylbutoxycarbonyl)benzoate Openeye Name: 3-decyl-4-isopentyloxycarbonyl-benzoate CAS Name: 3-decyl-4-[3-methylbutoxy(oxo)methyl]benzoate IUPAC Name: 3-decyl-4-(3-methylbutoxycarbonyl)benzoate Traditional Name: 3-decyl-4-isoamoxycarbonyl-benzoate Formula: C23H35O4- MolecularWeight: 375.5216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC1=C(C=CC(=C1)C(=O)[O-])C(=O)OCCC(C)C

Isomeric SMILES

CCCCCCCCCCC1=C(C=CC(=C1)C(=O)[O-])C(=O)OCCC(C)C

InChI

InChI=1S/C23H36O4/c1-4-5-6-7-8-9-10-11-12-19-17-20(22(24)25)13-14-21(19)23(26)27-16-15-18(2)3/h13-14,17-18H,4-12,15-16H2,1-3H3,(H,24,25)/p-1