(E)-[2-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-(4-prop-2-enoxyphenyl)methanolate

Systemtic Name: (E)-[2-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-4,5-bis(oxidanylidene)pyrrolidin-3-ylidene]-(4-prop-2-enoxyphenyl)methanolate Openeye Name: (E)-(4-allyloxyphenyl)-[2-(2-furyl)-1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxo-pyrrolidin-3-ylidene]methanolate CAS Name: (E)-[2-(2-furanyl)-1-[2-(4-morpholin-4-iumyl)ethyl]-4,5-dioxo-3-pyrrolidinylidene]-(4-prop-2-enoxyphenyl)methanolate IUPAC Name: (E)-[2-(furan-2-yl)-1-(2-morpholin-4-ium-4-ylethyl)-4,5-dioxopyrrolidin-3-ylidene]-(4-prop-2-enoxyphenyl)methanolate Traditional Name: (E)-(4-allyloxyphenyl)-[2-(2-furyl)-4,5-diketo-1-(2-morpholin-4-ium-4-ylethyl)pyrrolidin-3-ylidene]methanolate Formula: C24H26N2O6 MolecularWeight: 438.47304

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC1=CC=C(C=C1)C(=C2C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CO4)[O-]

Isomeric SMILES

C=CCOC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CC[NH+]3CCOCC3)C4=CC=CO4)/[O-]

InChI

InChI=1S/C24H26N2O6/c1-2-13-31-18-7-5-17(6-8-18)22(27)20-21(19-4-3-14-32-19)26(24(29)23(20)28)10-9-25-11-15-30-16-12-25/h2-8,14,21,27H,1,9-13,15-16H2/b22-20+