ethyl 1-[1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindol-5-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1,3-bis(oxidanylidene)-2-(oxolan-2-ylmethyl)isoindol-5-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1,3-dioxo-2-(tetrahydrofuran-2-ylmethyl)isoindoline-5-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1,3-dioxo-2-(2-oxolanylmethyl)-5-isoindolyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1,3-dioxo-2-(oxolan-2-ylmethyl)isoindole-5-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1,3-diketo-2-(tetrahydrofurfuryl)isoindoline-5-carbonyl]isonipecotic acid ethyl ester Formula: C22H26N2O6 MolecularWeight: 414.45164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC4CCCO4

InChI

InChI=1S/C22H26N2O6/c1-2-29-22(28)14-7-9-23(10-8-14)19(25)15-5-6-17-18(12-15)21(27)24(20(17)26)13-16-4-3-11-30-16/h5-6,12,14,16H,2-4,7-11,13H2,1H3