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

Systemtic Name: [2-oxidanylidene-2-(3-phenylpropylamino)ethyl] 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-furanylmethyl)-1,3-dioxo-5-isoindolecarboxylic acid [2-oxo-2-(3-phenylpropylamino)ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylpropylamino)ethyl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-furfuryl)-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-2-(3-phenylpropylamino)ethyl] ester Formula: C25H22N2O6 MolecularWeight: 446.45198

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CCCNC(=O)COC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CO4

InChI

InChI=1S/C25H22N2O6/c28-22(26-12-4-8-17-6-2-1-3-7-17)16-33-25(31)18-10-11-20-21(14-18)24(30)27(23(20)29)15-19-9-5-13-32-19/h1-3,5-7,9-11,13-14H,4,8,12,15-16H2,(H,26,28)