1-[(3R)-6-cyano-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-3-yl]-3-ethyl-urea

Systemtic Name: 1-[(3R)-6-cyano-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-3-yl]-3-ethyl-urea Openeye Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-chroman-3-yl]-3-ethyl-urea CAS Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl]-3-ethylurea IUPAC Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydrochromen-3-yl]-3-ethylurea Traditional Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-chroman-3-yl]-3-ethyl-urea Formula: C15H19N3O3 MolecularWeight: 289.32966

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)O

Isomeric SMILES

CCNC(=O)N[C@@H]1C(C2=C(C=CC(=C2)C#N)OC1(C)C)O

InChI

InChI=1S/C15H19N3O3/c1-4-17-14(20)18-13-12(19)10-7-9(8-16)5-6-11(10)21-15(13,2)3/h5-7,12-13,19H,4H2,1-3H3,(H2,17,18,20)/t12?,13-/m1/s1