1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-methyl-1-phenylmethoxy-urea

Systemtic Name: 1-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-3-methyl-1-phenylmethoxy-urea Openeye Name: 1-benzyloxy-1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-methyl-urea CAS Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)-3-methyl-1-phenylmethoxyurea IUPAC Name: 1-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-3-methyl-1-phenylmethoxyurea Traditional Name: 1-benzoxy-1-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-3-methyl-urea Formula: C21H23N3O4 MolecularWeight: 381.42502

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(C(=O)NC)OCC3=CC=CC=C3)O)C

Isomeric SMILES

CC1(C(C(C2=C(O1)C=CC(=C2)C#N)N(C(=O)NC)OCC3=CC=CC=C3)O)C

InChI

InChI=1S/C21H23N3O4/c1-21(2)19(25)18(16-11-15(12-22)9-10-17(16)28-21)24(20(26)23-3)27-13-14-7-5-4-6-8-14/h4-11,18-19,25H,13H2,1-3H3,(H,23,26)