tert-butyl 4-[[2-cyano-5-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl)phenyl]amino]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[2-cyano-5-(3,6,6-trimethyl-4-oxidanylidene-5,7-dihydroindol-1-yl)phenyl]amino]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[2-cyano-5-(3,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)anilino]piperidine-1-carboxylate CAS Name: 4-[2-cyano-5-(3,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)anilino]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-cyano-5-(3,6,6-trimethyl-4-oxo-5,7-dihydroindol-1-yl)anilino]piperidine-1-carboxylate Traditional Name: 4-[2-cyano-5-(4-keto-3,6,6-trimethyl-5,7-dihydroindol-1-yl)anilino]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H36N4O3 MolecularWeight: 476.61044

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=C1C(=O)CC(C2)(C)C)C3=CC(=C(C=C3)C#N)NC4CCN(CC4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=CN(C2=C1C(=O)CC(C2)(C)C)C3=CC(=C(C=C3)C#N)NC4CCN(CC4)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H36N4O3/c1-18-17-32(23-14-28(5,6)15-24(33)25(18)23)21-8-7-19(16-29)22(13-21)30-20-9-11-31(12-10-20)26(34)35-27(2,3)4/h7-8,13,17,20,30H,9-12,14-15H2,1-6H3