sodium 2-(1-cyclohexyl-2,3-dihydro-1H-inden-5-yl)ethanoate hydrate

Systemtic Name: sodium 2-(1-cyclohexyl-2,3-dihydro-1H-inden-5-yl)ethanoate hydrate Openeye Name: sodium 2-(1-cyclohexylindan-5-yl)acetate hydrate CAS Name: sodium 2-(1-cyclohexyl-2,3-dihydro-1H-inden-5-yl)acetate hydrate IUPAC Name: sodium 2-(1-cyclohexyl-2,3-dihydro-1H-inden-5-yl)acetate hydrate Traditional Name: sodium 2-(1-cyclohexylindan-5-yl)acetate hydrate Formula: C17H23NaO3 MolecularWeight: 298.35249

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CCC3=C2C=CC(=C3)CC(=O)[O-].O.[Na+]

Isomeric SMILES

C1CCC(CC1)C2CCC3=C2C=CC(=C3)CC(=O)[O-].O.[Na+]

InChI

InChI=1S/C17H22O2.Na.H2O/c18-17(19)11-12-6-8-16-14(10-12)7-9-15(16)13-4-2-1-3-5-13;;/h6,8,10,13,15H,1-5,7,9,11H2,(H,18,19);;1H2/q;+1;/p-1