sodium (Z)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)but-2-enoate

Systemtic Name: sodium (Z)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxidanylidene-3-(phenylmethyl)but-2-enoate Openeye Name: sodium (Z)-3-benzyl-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-but-2-enoate CAS Name: sodium (Z)-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxo-3-(phenylmethyl)-2-butenoate IUPAC Name: sodium (Z)-3-benzyl-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)-4-oxobut-2-enoate Traditional Name: sodium (Z)-3-benzyl-4-keto-2-(7-methoxy-1,3-benzodioxol-5-yl)-4-(4-methoxyphenyl)but-2-enoate Formula: C26H21NaO7 MolecularWeight: 468.43051

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C(=C(C2=CC3=C(C(=C2)OC)OCO3)C(=O)[O-])CC4=CC=CC=C4.[Na+]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)/C(=C(/C2=CC3=C(C(=C2)OC)OCO3)\C(=O)[O-])/CC4=CC=CC=C4.[Na+]

InChI

InChI=1S/C26H22O7.Na/c1-30-19-10-8-17(9-11-19)24(27)20(12-16-6-4-3-5-7-16)23(26(28)29)18-13-21(31-2)25-22(14-18)32-15-33-25;/h3-11,13-14H,12,15H2,1-2H3,(H,28,29);/q;+1/p-1/b23-20-;