N-[N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-C-pyridin-2-yl-carbonimidoyl]ethanamide

Systemtic Name: N-[N-(6-cyano-2,2-dimethyl-3-oxidanyl-3,4-dihydrochromen-4-yl)-C-pyridin-2-yl-carbonimidoyl]ethanamide Openeye Name: N-[N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-C-(2-pyridyl)carbonimidoyl]acetamide CAS Name: N-[(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydro-2H-1-benzopyran-4-yl)imino-(2-pyridinyl)methyl]acetamide IUPAC Name: N-[N-(6-cyano-3-hydroxy-2,2-dimethyl-3,4-dihydrochromen-4-yl)-C-pyridin-2-ylcarbonimidoyl]acetamide Traditional Name: N-[N-(6-cyano-3-hydroxy-2,2-dimethyl-chroman-4-yl)-C-(2-pyridyl)carbonimidoyl]acetamide Formula: C20H20N4O3 MolecularWeight: 364.3978

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(=NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C3=CC=CC=N3

Isomeric SMILES

CC(=O)NC(=NC1C(C(OC2=C1C=C(C=C2)C#N)(C)C)O)C3=CC=CC=N3

InChI

InChI=1S/C20H20N4O3/c1-12(25)23-19(15-6-4-5-9-22-15)24-17-14-10-13(11-21)7-8-16(14)27-20(2,3)18(17)26/h4-10,17-18,26H,1-3H3,(H,23,24,25)