2-(4,8-dimethyl-5-oxidanyl-nonyl)-2-methyl-oxepan-3-olate

Systemtic Name: 2-(4,8-dimethyl-5-oxidanyl-nonyl)-2-methyl-oxepan-3-olate Openeye Name: 2-(5-hydroxy-4,8-dimethyl-nonyl)-2-methyl-oxepan-3-olate CAS Name: 2-(5-hydroxy-4,8-dimethylnonyl)-2-methyl-3-oxepanolate IUPAC Name: 2-(5-hydroxy-4,8-dimethylnonyl)-2-methyloxepan-3-olate Traditional Name: 2-(5-hydroxy-4,8-dimethyl-nonyl)-2-methyl-oxepan-3-olate Formula: C18H35O3- MolecularWeight: 299.4687

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(C(C)CCCC1(C(CCCCO1)[O-])C)O

Isomeric SMILES

CC(C)CCC(C(C)CCCC1(C(CCCCO1)[O-])C)O

InChI

InChI=1S/C18H35O3/c1-14(2)10-11-16(19)15(3)8-7-12-18(4)17(20)9-5-6-13-21-18/h14-17,19H,5-13H2,1-4H3/q-1