[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-furanylmethyl)-1,3-dioxo-5-isoindolecarboxylic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-furfuryl)-1,3-diketo-isoindoline-5-carboxylic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H21N3O7 MolecularWeight: 427.40734

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC=CO3

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3=CC=CO3

InChI

InChI=1S/C21H21N3O7/c1-12(2)9-22-21(29)23-17(25)11-31-20(28)13-5-6-15-16(8-13)19(27)24(18(15)26)10-14-4-3-7-30-14/h3-8,12H,9-11H2,1-2H3,(H2,22,23,25,29)