2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate

Systemtic Name: 2-[1,3-bis(oxidanylidene)isoindol-2-yl]ethyl 1-(5-aminocarbonylpyridin-2-yl)piperidine-4-carboxylate Openeye Name: 2-(1,3-dioxoisoindolin-2-yl)ethyl 1-(5-carbamoyl-2-pyridyl)piperidine-4-carboxylate CAS Name: 1-(5-carbamoyl-2-pyridinyl)-4-piperidinecarboxylic acid 2-(1,3-dioxo-2-isoindolyl)ethyl ester IUPAC Name: 2-(1,3-dioxoisoindol-2-yl)ethyl 1-(5-carbamoylpyridin-2-yl)piperidine-4-carboxylate Traditional Name: 1-(5-carbamoyl-2-pyridyl)isonipecotic acid 2-phthalimidoethyl ester Formula: C22H22N4O5 MolecularWeight: 422.43388

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C4=NC=C(C=C4)C(=O)N

Isomeric SMILES

C1CN(CCC1C(=O)OCCN2C(=O)C3=CC=CC=C3C2=O)C4=NC=C(C=C4)C(=O)N

InChI

InChI=1S/C22H22N4O5/c23-19(27)15-5-6-18(24-13-15)25-9-7-14(8-10-25)22(30)31-12-11-26-20(28)16-3-1-2-4-17(16)21(26)29/h1-6,13-14H,7-12H2,(H2,23,27)