6-(carboxymethyl)-2-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-2-methyl-oxepan-3-olate

Systemtic Name: 6-(carboxymethyl)-2-(4,8-dimethyl-5-oxidanylidene-non-7-enyl)-2-methyl-oxepan-3-olate Openeye Name: 6-(carboxymethyl)-2-(4,8-dimethyl-5-oxo-non-7-enyl)-2-methyl-oxepan-3-olate CAS Name: 6-(carboxymethyl)-2-(4,8-dimethyl-5-oxonon-7-enyl)-2-methyl-3-oxepanolate IUPAC Name: 6-(carboxymethyl)-2-(4,8-dimethyl-5-oxonon-7-enyl)-2-methyloxepan-3-olate Traditional Name: 6-(carboxymethyl)-2-(5-keto-4,8-dimethyl-non-7-enyl)-2-methyl-oxepan-3-olate Formula: C20H33O5- MolecularWeight: 353.47302

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1(C(CCC(CO1)CC(=O)O)[O-])C)C(=O)CC=C(C)C

Isomeric SMILES

CC(CCCC1(C(CCC(CO1)CC(=O)O)[O-])C)C(=O)CC=C(C)C

InChI

InChI=1S/C20H33O5/c1-14(2)7-9-17(21)15(3)6-5-11-20(4)18(22)10-8-16(13-25-20)12-19(23)24/h7,15-16,18H,5-6,8-13H2,1-4H3,(H,23,24)/q-1