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

Systemtic Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxidanylidenepyridin-1-yl)chromen-3-yl]methyl]-3-ethyl-urea Openeye Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridyl)chromen-3-yl]methyl]-3-ethyl-urea CAS Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxo-1-pyridinyl)-1-benzopyran-3-yl]methyl]-3-ethylurea IUPAC Name: 1-[[2,2-dimethyl-6-nitro-4-(2-oxopyridin-1-yl)chromen-3-yl]methyl]-3-ethylurea Traditional Name: 1-ethyl-3-[[4-(2-keto-1-pyridyl)-2,2-dimethyl-6-nitro-chromen-3-yl]methyl]urea Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O5/c1-4-21-19(26)22-12-15-18(23-10-6-5-7-17(23)25)14-11-13(24(27)28)8-9-16(14)29-20(15,2)3/h5-11H,4,12H2,1-3H3,(H2,21,22,26)