[1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate

Systemtic Name: [1-oxidanylidene-1-(1-phenylbutylamino)propan-2-yl] 2-(furan-2-ylmethyl)-1,3-bis(oxidanylidene)isoindole-5-carboxylate Openeye Name: [1-methyl-2-oxo-2-(1-phenylbutylamino)ethyl] 2-(2-furylmethyl)-1,3-dioxo-isoindoline-5-carboxylate CAS Name: 2-(2-furanylmethyl)-1,3-dioxo-5-isoindolecarboxylic acid [1-oxo-1-(1-phenylbutylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(1-phenylbutylamino)propan-2-yl] 2-(furan-2-ylmethyl)-1,3-dioxoisoindole-5-carboxylate Traditional Name: 2-(2-furfuryl)-1,3-diketo-isoindoline-5-carboxylic acid [2-keto-1-methyl-2-(1-phenylbutylamino)ethyl] ester Formula: C27H26N2O6 MolecularWeight: 474.50514

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CO4

Isomeric SMILES

CCCC(C1=CC=CC=C1)NC(=O)C(C)OC(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4=CC=CO4

InChI

InChI=1S/C27H26N2O6/c1-3-8-23(18-9-5-4-6-10-18)28-24(30)17(2)35-27(33)19-12-13-21-22(15-19)26(32)29(25(21)31)16-20-11-7-14-34-20/h4-7,9-15,17,23H,3,8,16H2,1-2H3,(H,28,30)