tert-butyl N-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]carbamate

Systemtic Name: tert-butyl N-[(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)amino]carbamate Openeye Name: tert-butyl N-[(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)amino]carbamate CAS Name: N-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)amino]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)amino]carbamate Traditional Name: N-[(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)amino]carbamic acid tert-butyl ester Formula: C17H23N3O4 MolecularWeight: 333.38222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N3O4/c1-16(2,3)24-15(22)20-19-13-11-8-10(9-18)6-7-12(11)23-17(4,5)14(13)21/h6-8,13-14,19,21H,1-5H3,(H,20,22)