sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4-oxidanylidene-but-2-enoate

Systemtic Name: sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4-oxidanylidene-but-2-enoate Openeye Name: sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4-oxo-but-2-enoate CAS Name: sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4-oxo-2-butenoate IUPAC Name: sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-(4-methoxyphenyl)-4-oxobut-2-enoate Traditional Name: sodium (E)-3-(cyclohexylmethyl)-2-(3,5-dimethoxyphenyl)-4-keto-4-(4-methoxyphenyl)but-2-enoate Formula: C26H29NaO6 MolecularWeight: 460.49463

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(C2=CC(=CC(=C2)OC)OC)C(=O)[O-])CC3CCCCC3.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(\C2=CC(=CC(=C2)OC)OC)/C(=O)[O-])/CC3CCCCC3.[Na+]

InChI

InChI=1S/C26H30O6.Na/c1-30-20-11-9-18(10-12-20)25(27)23(13-17-7-5-4-6-8-17)24(26(28)29)19-14-21(31-2)16-22(15-19)32-3;/h9-12,14-17H,4-8,13H2,1-3H3,(H,28,29);/q;+1/p-1/b24-23+;