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

Systemtic Name: tert-butyl 2-[(6-cyano-2,2-dimethyl-chromen-4-yl)carbamoyl]piperidine-1-carboxylate Openeye Name: tert-butyl 2-[(6-cyano-2,2-dimethyl-chromen-4-yl)carbamoyl]piperidine-1-carboxylate CAS Name: 2-[[(6-cyano-2,2-dimethyl-1-benzopyran-4-yl)amino]-oxomethyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-[(6-cyano-2,2-dimethylchromen-4-yl)carbamoyl]piperidine-1-carboxylate Traditional Name: 2-[(6-cyano-2,2-dimethyl-chromen-4-yl)carbamoyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H29N3O4 MolecularWeight: 411.49406

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3CCCCN3C(=O)OC(C)(C)C)C

Isomeric SMILES

CC1(C=C(C2=C(O1)C=CC(=C2)C#N)NC(=O)C3CCCCN3C(=O)OC(C)(C)C)C

InChI

InChI=1S/C23H29N3O4/c1-22(2,3)30-21(28)26-11-7-6-8-18(26)20(27)25-17-13-23(4,5)29-19-10-9-15(14-24)12-16(17)19/h9-10,12-13,18H,6-8,11H2,1-5H3,(H,25,27)