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

Systemtic Name: ethyl 1-[1-[2-cycloheptyl-1,3-bis(oxidanylidene)isoindol-4-yl]piperidin-4-yl]carbonylpiperidine-2-carboxylate Openeye Name: ethyl 1-[1-(2-cycloheptyl-1,3-dioxo-isoindolin-4-yl)piperidine-4-carbonyl]piperidine-2-carboxylate CAS Name: 1-[[1-(2-cycloheptyl-1,3-dioxo-4-isoindolyl)-4-piperidinyl]-oxomethyl]-2-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[1-(2-cycloheptyl-1,3-dioxoisoindol-4-yl)piperidine-4-carbonyl]piperidine-2-carboxylate Traditional Name: 1-[1-(2-cycloheptyl-1,3-diketo-isoindolin-4-yl)isonipecotoyl]pipecolinic acid ethyl ester Formula: C29H39N3O5 MolecularWeight: 509.63706

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCCN1C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCC5

Isomeric SMILES

CCOC(=O)C1CCCCN1C(=O)C2CCN(CC2)C3=CC=CC4=C3C(=O)N(C4=O)C5CCCCCC5

InChI

InChI=1S/C29H39N3O5/c1-2-37-29(36)24-13-7-8-17-31(24)26(33)20-15-18-30(19-16-20)23-14-9-12-22-25(23)28(35)32(27(22)34)21-10-5-3-4-6-11-21/h9,12,14,20-21,24H,2-8,10-11,13,15-19H2,1H3