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

Systemtic Name: ethyl 4-[1-[2-cyclooctyl-1,3-bis(oxidanylidene)isoindol-4-yl]piperidin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[1-(2-cyclooctyl-1,3-dioxo-isoindolin-4-yl)piperidine-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[1-(2-cyclooctyl-1,3-dioxo-4-isoindolyl)-4-piperidinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[1-(2-cyclooctyl-1,3-dioxoisoindol-4-yl)piperidine-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-[1-(2-cyclooctyl-1,3-diketo-isoindolin-4-yl)isonipecotoyl]piperazine-1-carboxylic acid ethyl ester Formula: C29H40N4O5 MolecularWeight: 524.6517

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCCC5

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCCC5

InChI

InChI=1S/C29H40N4O5/c1-2-38-29(37)32-19-17-31(18-20-32)26(34)21-13-15-30(16-14-21)24-12-8-11-23-25(24)28(36)33(27(23)35)22-9-6-4-3-5-7-10-22/h8,11-12,21-22H,2-7,9-10,13-20H2,1H3