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

Systemtic Name: 1-[(3R)-6-cyano-2,2-dimethyl-4-oxidanyl-3,4-dihydrochromen-3-yl]-3-cyclohexyl-urea Openeye Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-chroman-3-yl]-3-cyclohexyl-urea CAS Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl]-3-cyclohexylurea IUPAC Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-3,4-dihydrochromen-3-yl]-3-cyclohexylurea Traditional Name: 1-[(3R)-6-cyano-4-hydroxy-2,2-dimethyl-chroman-3-yl]-3-cyclohexyl-urea Formula: C19H25N3O3 MolecularWeight: 343.4201

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)O)NC(=O)NC3CCCCC3)C

Isomeric SMILES

CC1([C@@H](C(C2=C(O1)C=CC(=C2)C#N)O)NC(=O)NC3CCCCC3)C

InChI

InChI=1S/C19H25N3O3/c1-19(2)17(22-18(24)21-13-6-4-3-5-7-13)16(23)14-10-12(11-20)8-9-15(14)25-19/h8-10,13,16-17,23H,3-7H2,1-2H3,(H2,21,22,24)/t16?,17-/m1/s1