4-[[[2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]methyl]benzoate

Systemtic Name: 4-[[[2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]methyl]benzoate Openeye Name: 4-[[[2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[[2-(2-furanylmethyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[[2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[[2-(2-furfuryl)-1,3-diketo-isoindoline-5-carbonyl]amino]methyl]benzoate Formula: C22H15N2O6- MolecularWeight: 403.3643

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)C(=O)[O-]

Isomeric SMILES

C1=COC(=C1)CN2C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)C(=O)[O-]

InChI

InChI=1S/C22H16N2O6/c25-19(23-11-13-3-5-14(6-4-13)22(28)29)15-7-8-17-18(10-15)21(27)24(20(17)26)12-16-2-1-9-30-16/h1-10H,11-12H2,(H,23,25)(H,28,29)/p-1