4-chloranyl-N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-3-nitro-benzamide CAS Name: 4-chloro-N-[[5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[[5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl]-3-nitro-benzamide Formula: C19H16ClN3O6 MolecularWeight: 417.79984

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16ClN3O6/c1-27-16-6-4-11(8-18(16)28-2)17-9-13(22-29-17)10-21-19(24)12-3-5-14(20)15(7-12)23(25)26/h3-9H,10H2,1-2H3,(H,21,24)