N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-2-nitro-benzamide

Systemtic Name: N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-2-nitro-benzamide Openeye Name: N-[2-(m-tolyl)-1,3-benzoxazol-5-yl]-2-nitro-benzamide CAS Name: N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide IUPAC Name: N-[2-(3-methylphenyl)-1,3-benzoxazol-5-yl]-2-nitrobenzamide Traditional Name: N-[2-(m-tolyl)-1,3-benzoxazol-5-yl]-2-nitro-benzamide Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(O2)C=CC(=C3)NC(=O)C4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C21H15N3O4/c1-13-5-4-6-14(11-13)21-23-17-12-15(9-10-19(17)28-21)22-20(25)16-7-2-3-8-18(16)24(26)27/h2-12H,1H3,(H,22,25)