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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(CC2=C(O1)C=CC(=C2)C#N)(NNC(=O)OC(C)(C)C)O)C

Isomeric SMILES

CC1(C(CC2=C(O1)C=CC(=C2)C#N)(NNC(=O)OC(C)(C)C)O)C

InChI

InChI=1S/C17H23N3O4/c1-15(2,3)24-14(21)19-20-17(22)9-12-8-11(10-18)6-7-13(12)23-16(17,4)5/h6-8,20,22H,9H2,1-5H3,(H,19,21)