4-[(2-nonylphenyl)methoxycarbonyloxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(2-nonylphenyl)methoxycarbonyloxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2-nonylphenyl)methoxycarbonyloxy]-4-oxo-butanoic acid CAS Name: 4-[(2-nonylphenyl)methoxy-oxomethoxy]-4-oxobutanoic acid IUPAC Name: 4-[(2-nonylphenyl)methoxycarbonyloxy]-4-oxobutanoic acid Traditional Name: 4-keto-4-(2-nonylbenzyl)oxycarbonyloxy-butyric acid Formula: C21H30O6 MolecularWeight: 378.4593

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC1=CC=CC=C1COC(=O)OC(=O)CCC(=O)O

Isomeric SMILES

CCCCCCCCCC1=CC=CC=C1COC(=O)OC(=O)CCC(=O)O

InChI

InChI=1S/C21H30O6/c1-2-3-4-5-6-7-8-11-17-12-9-10-13-18(17)16-26-21(25)27-20(24)15-14-19(22)23/h9-10,12-13H,2-8,11,14-16H2,1H3,(H,22,23)