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

Systemtic Name: ethyl N-[[2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]carbamate Openeye Name: ethyl N-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]carbamate CAS Name: N-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2,2-dimethyl-6-nitro-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]carbamate Traditional Name: N-[[4-(2-keto-1-pyridyl)-2,2-dimethyl-6-nitro-chromen-3-yl]methyl]carbamic acid ethyl ester Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NCC1=C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)N3C=CC=CC3=O

Isomeric SMILES

CCOC(=O)NCC1=C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)N3C=CC=CC3=O

InChI

InChI=1S/C20H21N3O6/c1-4-28-19(25)21-12-15-18(22-10-6-5-7-17(22)24)14-11-13(23(26)27)8-9-16(14)29-20(15,2)3/h5-11H,4,12H2,1-3H3,(H,21,25)