ethyl N-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]carbamate

Systemtic Name: ethyl N-[[6-cyano-2,2-dimethyl-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]carbamate Openeye Name: ethyl N-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]carbamate CAS Name: N-[[6-cyano-2,2-dimethyl-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[6-cyano-2,2-dimethyl-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]carbamate Traditional Name: N-[[6-cyano-4-(2-keto-1-pyridyl)-2,2-dimethyl-chromen-3-yl]methyl]carbamic acid ethyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCOC(=O)NCC1=C(C2=C(C=CC(=C2)C#N)OC1(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C21H21N3O4/c1-4-27-20(26)23-13-16-19(24-10-6-5-7-18(24)25)15-11-14(12-22)8-9-17(15)28-21(16,2)3/h5-11H,4,13H2,1-3H3,(H,23,26)