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

Systemtic Name: N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]-2-nitro-benzamide Openeye Name: 2-nitro-N-[[5-(p-tolyl)isoxazol-3-yl]methyl]benzamide CAS Name: N-[[5-(4-methylphenyl)-3-isoxazolyl]methyl]-2-nitrobenzamide IUPAC Name: N-[[5-(4-methylphenyl)-1,2-oxazol-3-yl]methyl]-2-nitrobenzamide Traditional Name: 2-nitro-N-[[5-(p-tolyl)isoxazol-3-yl]methyl]benzamide Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NO2)CNC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C18H15N3O4/c1-12-6-8-13(9-7-12)17-10-14(20-25-17)11-19-18(22)15-4-2-3-5-16(15)21(23)24/h2-10H,11H2,1H3,(H,19,22)