(E)-(4-methoxyphenyl)-[2-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]methanolate

Systemtic Name: (E)-(4-methoxyphenyl)-[2-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]methanolate Openeye Name: (E)-(4-methoxyphenyl)-[2-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-dioxo-pyrrolidin-3-ylidene]methanolate CAS Name: (E)-(4-methoxyphenyl)-[2-(2-methoxyphenyl)-1-[3-(4-morpholin-4-iumyl)propyl]-4,5-dioxo-3-pyrrolidinylidene]methanolate IUPAC Name: (E)-(4-methoxyphenyl)-[2-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)-4,5-dioxopyrrolidin-3-ylidene]methanolate Traditional Name: (E)-[4,5-diketo-2-(2-methoxyphenyl)-1-(3-morpholin-4-ium-4-ylpropyl)pyrrolidin-3-ylidene]-(4-methoxyphenyl)methanolate Formula: C26H30N2O6 MolecularWeight: 466.5262

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=CC=C4OC)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCC[NH+]3CCOCC3)C4=CC=CC=C4OC)/[O-]

InChI

InChI=1S/C26H30N2O6/c1-32-19-10-8-18(9-11-19)24(29)22-23(20-6-3-4-7-21(20)33-2)28(26(31)25(22)30)13-5-12-27-14-16-34-17-15-27/h3-4,6-11,23,29H,5,12-17H2,1-2H3/b24-22+