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

Systemtic Name: ethyl 1-[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carbonyl]piperidine-3-carboxylate CAS Name: 1-[[2-(3-methoxypropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]piperidine-3-carboxylate Traditional Name: 1-[1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carbonyl]nipecotic acid ethyl ester Formula: C21H26N2O6 MolecularWeight: 402.44094

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CCCOC

InChI

InChI=1S/C21H26N2O6/c1-3-29-21(27)15-6-4-9-22(13-15)18(24)14-7-8-16-17(12-14)20(26)23(19(16)25)10-5-11-28-2/h7-8,12,15H,3-6,9-11,13H2,1-2H3