[6-cyano-4-[2-(cyanoamino)-5,5-dimethyl-4H-imidazol-3-yl]-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate

Systemtic Name: [6-cyano-4-[2-(cyanoamino)-5,5-dimethyl-4H-imidazol-3-yl]-2,2-dimethyl-3,4-dihydrochromen-3-yl] ethanoate Openeye Name: [6-cyano-4-[2-(cyanoamino)-5,5-dimethyl-4H-imidazol-3-yl]-2,2-dimethyl-chroman-3-yl] acetate CAS Name: acetic acid [6-cyano-4-[2-(cyanoamino)-5,5-dimethyl-4H-imidazol-3-yl]-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-3-yl] ester IUPAC Name: [6-cyano-4-[2-(cyanoamino)-5,5-dimethyl-4H-imidazol-3-yl]-2,2-dimethyl-3,4-dihydrochromen-3-yl] acetate Traditional Name: acetic acid [6-cyano-4-[2-(cyanoamino)-4,4-dimethyl-2-imidazolin-1-yl]-2,2-dimethyl-chroman-3-yl] ester Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC(N=C3NC#N)(C)C

Isomeric SMILES

CC(=O)OC1C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3CC(N=C3NC#N)(C)C

InChI

InChI=1S/C20H23N5O3/c1-12(26)27-17-16(25-10-19(2,3)24-18(25)23-11-22)14-8-13(9-21)6-7-15(14)28-20(17,4)5/h6-8,16-17H,10H2,1-5H3,(H,23,24)