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

Systemtic Name: ethyl 4-[3-[[2-(3-ethoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[3-[[2-(3-ethoxypropyl)-3-oxo-isoindolin-1-yl]amino]benzoyl]piperazine-1-carboxylate CAS Name: 4-[[3-[[2-(3-ethoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]phenyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-[[2-(3-ethoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]benzoyl]piperazine-1-carboxylate Traditional Name: 4-[3-[[2-(3-ethoxypropyl)-3-keto-isoindolin-1-yl]amino]benzoyl]piperazine-1-carboxylic acid ethyl ester Formula: C27H34N4O5 MolecularWeight: 494.58266

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOCCCN1C(C2=CC=CC=C2C1=O)NC3=CC=CC(=C3)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C27H34N4O5/c1-3-35-18-8-13-31-24(22-11-5-6-12-23(22)26(31)33)28-21-10-7-9-20(19-21)25(32)29-14-16-30(17-15-29)27(34)36-4-2/h5-7,9-12,19,24,28H,3-4,8,13-18H2,1-2H3