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

Systemtic Name: ethyl 1-[3-[[2-(3-methoxypropyl)-3-oxidanylidene-1H-isoindol-1-yl]amino]phenyl]carbonylpiperidine-3-carboxylate Openeye Name: ethyl 1-[3-[[2-(3-methoxypropyl)-3-oxo-isoindolin-1-yl]amino]benzoyl]piperidine-3-carboxylate CAS Name: 1-[[3-[[2-(3-methoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]phenyl]-oxomethyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-[[2-(3-methoxypropyl)-3-oxo-1H-isoindol-1-yl]amino]benzoyl]piperidine-3-carboxylate Traditional Name: 1-[3-[[3-keto-2-(3-methoxypropyl)isoindolin-1-yl]amino]benzoyl]nipecotic acid ethyl ester Formula: C27H33N3O5 MolecularWeight: 479.56802

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOC

Isomeric SMILES

CCOC(=O)C1CCCN(C1)C(=O)C2=CC(=CC=C2)NC3C4=CC=CC=C4C(=O)N3CCCOC

InChI

InChI=1S/C27H33N3O5/c1-3-35-27(33)20-10-7-14-29(18-20)25(31)19-9-6-11-21(17-19)28-24-22-12-4-5-13-23(22)26(32)30(24)15-8-16-34-2/h4-6,9,11-13,17,20,24,28H,3,7-8,10,14-16,18H2,1-2H3