sodium 4-cyclohexyloxy-4-oxidanylidene-3-sulfo-butanoate

Systemtic Name: sodium 4-cyclohexyloxy-4-oxidanylidene-3-sulfo-butanoate Openeye Name: sodium 4-(cyclohexoxy)-4-oxo-3-sulfo-butanoate CAS Name: sodium 4-cyclohexyloxy-4-oxo-3-sulfobutanoate IUPAC Name: sodium 4-cyclohexyloxy-4-oxo-3-sulfobutanoate Traditional Name: sodium 4-(cyclohexoxy)-4-keto-3-sulfo-butyrate Formula: C10H15NaO7S MolecularWeight: 302.27667

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)OC(=O)C(CC(=O)[O-])S(=O)(=O)O.[Na+]

Isomeric SMILES

C1CCC(CC1)OC(=O)C(CC(=O)[O-])S(=O)(=O)O.[Na+]

InChI

InChI=1S/C10H16O7S.Na/c11-9(12)6-8(18(14,15)16)10(13)17-7-4-2-1-3-5-7;/h7-8H,1-6H2,(H,11,12)(H,14,15,16);/q;+1/p-1