ethyl 1-[1-[2-cyclooctyl-1,3-bis(oxidanylidene)isoindol-4-yl]piperidin-3-yl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[1-[2-cyclooctyl-1,3-bis(oxidanylidene)isoindol-4-yl]piperidin-3-yl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[1-(2-cyclooctyl-1,3-dioxo-isoindolin-4-yl)piperidine-3-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[1-(2-cyclooctyl-1,3-dioxo-4-isoindolyl)-3-piperidinyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2-cyclooctyl-1,3-dioxoisoindol-4-yl)piperidine-3-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[1-(2-cyclooctyl-1,3-diketo-isoindolin-4-yl)nipecotoyl]isonipecotic acid ethyl ester Formula: C30H41N3O5 MolecularWeight: 523.66364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCCC5

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C(=O)C2CCCN(C2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCCC5

InChI

InChI=1S/C30H41N3O5/c1-2-38-30(37)21-15-18-31(19-16-21)27(34)22-10-9-17-32(20-22)25-14-8-13-24-26(25)29(36)33(28(24)35)23-11-6-4-3-5-7-12-23/h8,13-14,21-23H,2-7,9-12,15-20H2,1H3