tert-butyl 4-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)carbamoyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 4-[[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 4-[(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H31N3O5 MolecularWeight: 429.50934

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3CCN(CC3)C(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C23H31N3O5/c1-22(2,3)31-21(29)26-10-8-15(9-11-26)20(28)25-18-16-12-14(13-24)6-7-17(16)30-23(4,5)19(18)27/h6-7,12,15,18-19,27H,8-11H2,1-5H3,(H,25,28)