ethyl 1-[3-[[2-(3-ethoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperidine-4-carboxylate

Systemtic Name: ethyl 1-[3-[[2-(3-ethoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperidine-4-carboxylate Openeye Name: ethyl 1-[3-[[2-(3-ethoxypropyl)-3-oxo-isoindolin-1-yl]amino]benzoyl]piperidine-4-carboxylate CAS Name: 1-[[3-[[2-(3-ethoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]phenyl]-oxomethyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[2-(3-ethoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]benzoyl]piperidine-4-carboxylate Traditional Name: 1-[3-[[2-(3-ethoxypropyl)-3-keto-isoindolin-1-yl]amino]benzoyl]isonipecotic acid ethyl ester Formula: C28H35N3O5 MolecularWeight: 493.5946

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCC(CC4)C(=O)OCC

Isomeric SMILES

CCOCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCC(CC4)C(=O)OCC

InChI

InChI=1S/C28H35N3O5/c1-3-35-18-8-15-31-25(23-11-5-6-12-24(23)27(31)33)29-22-10-7-9-21(19-22)26(32)30-16-13-20(14-17-30)28(34)36-4-2/h5-7,9-12,19-20,25,29H,3-4,8,13-18H2,1-2H3