[2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate

Systemtic Name: [2-[(1-cyanocyclohexyl)amino]-2-oxidanylidene-ethyl] 2-(2,3-dihydroindol-1-ylcarbonyl)cyclohexane-1-carboxylate Openeye Name: [2-[(1-cyanocyclohexyl)amino]-2-oxo-ethyl] 2-(indoline-1-carbonyl)cyclohexanecarboxylate CAS Name: 2-[2,3-dihydroindol-1-yl(oxo)methyl]-1-cyclohexanecarboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(1-cyanocyclohexyl)amino]-2-oxoethyl] 2-(2,3-dihydroindole-1-carbonyl)cyclohexane-1-carboxylate Traditional Name: 2-(indoline-1-carbonyl)cyclohexanecarboxylic acid [2-[(1-cyanocyclohexyl)amino]-2-keto-ethyl] ester Formula: C25H31N3O4 MolecularWeight: 437.53134

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2CCCCC2C(=O)N3CCC4=CC=CC=C43

Isomeric SMILES

C1CCC(CC1)(C#N)NC(=O)COC(=O)C2CCCCC2C(=O)N3CCC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O4/c26-17-25(13-6-1-7-14-25)27-22(29)16-32-24(31)20-10-4-3-9-19(20)23(30)28-15-12-18-8-2-5-11-21(18)28/h2,5,8,11,19-20H,1,3-4,6-7,9-10,12-16H2,(H,27,29)