sodium 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylate

Systemtic Name: sodium 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxidanylidene-prop-1-enyl]cyclopentane-1-carboxylate Openeye Name: sodium 1-[(E)-3-tert-butoxy-2-(2-methoxyethoxymethyl)-3-oxo-prop-1-enyl]cyclopentanecarboxylate CAS Name: sodium 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]-1-cyclopentanecarboxylate IUPAC Name: sodium 1-[(E)-2-(2-methoxyethoxymethyl)-3-[(2-methylpropan-2-yl)oxy]-3-oxoprop-1-enyl]cyclopentane-1-carboxylate Traditional Name: sodium 1-[(E)-3-tert-butoxy-3-keto-2-(2-methoxyethoxymethyl)prop-1-enyl]cyclopentanecarboxylate Formula: C17H27NaO6 MolecularWeight: 350.38245

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C(=CC1(CCCC1)C(=O)[O-])COCCOC.[Na+]

Isomeric SMILES

CC(C)(C)OC(=O)/C(=C/C1(CCCC1)C(=O)[O-])/COCCOC.[Na+]

InChI

InChI=1S/C17H28O6.Na/c1-16(2,3)23-14(18)13(12-22-10-9-21-4)11-17(15(19)20)7-5-6-8-17;/h11H,5-10,12H2,1-4H3,(H,19,20);/q;+1/p-1/b13-11+;