sodium (E)-3-(2-methylpropoxycarbonyl)-2,2,3-tris[(E)-prop-1-enyl]hex-4-enoate

Systemtic Name: sodium (E)-3-(2-methylpropoxycarbonyl)-2,2,3-tris[(E)-prop-1-enyl]hex-4-enoate Openeye Name: sodium (E)-3-isobutoxycarbonyl-2,2,3-tris[(E)-prop-1-enyl]hex-4-enoate CAS Name: sodium (E)-3-[2-methylpropoxy(oxo)methyl]-2,2,3-tris[(E)-prop-1-enyl]-4-hexenoate IUPAC Name: sodium (E)-3-(2-methylpropoxycarbonyl)-2,2,3-tris[(E)-prop-1-enyl]hex-4-enoate Traditional Name: sodium (E)-3-isobutoxycarbonyl-2,2,3-tris[(E)-prop-1-enyl]hex-4-enoate Formula: C20H29NaO4 MolecularWeight: 356.43163

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(C=CC)(C(=O)[O-])C(C=CC)(C=CC)C(=O)OCC(C)C.[Na+]

Isomeric SMILES

C/C=C/C(C(C(=O)OCC(C)C)(/C=C/C)/C=C/C)(C(=O)[O-])/C=C/C.[Na+]

InChI

InChI=1S/C20H30O4.Na/c1-7-11-19(12-8-2,17(21)22)20(13-9-3,14-10-4)18(23)24-15-16(5)6;/h7-14,16H,15H2,1-6H3,(H,21,22);/q;+1/p-1/b11-7+,12-8+,13-9+,14-10+;