[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carboxylate CAS Name: 1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolecarboxylic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carboxylate Traditional Name: 1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carboxylic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C19H18N2O6 MolecularWeight: 370.35602

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C#CCNC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

Isomeric SMILES

C#CCNC(=O)COC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC3CCCO3

InChI

InChI=1S/C19H18N2O6/c1-2-7-20-16(22)11-27-19(25)12-5-6-14-15(9-12)18(24)21(17(14)23)10-13-4-3-8-26-13/h1,5-6,9,13H,3-4,7-8,10-11H2,(H,20,22)