3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide

Systemtic Name: 3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide Openeye Name: 3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide CAS Name: 3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide IUPAC Name: 3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide Traditional Name: 3-methyl-N-[2-(6-nitro-1,3-benzoxazol-2-yl)phenyl]benzamide Formula: C21H15N3O4 MolecularWeight: 373.3615

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=CC=C2C3=NC4=C(O3)C=C(C=C4)[N+](=O)[O-]

InChI

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