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

Systemtic Name: 4-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-benzamide CAS Name: 4-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide IUPAC Name: 4-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-methyl-N-[3-(5-methyl-1,3-benzoxazol-2-yl)phenyl]-3-nitro-benzamide Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c1-13-6-9-20-18(10-13)24-22(29-20)16-4-3-5-17(11-16)23-21(26)15-8-7-14(2)19(12-15)25(27)28/h3-12H,1-2H3,(H,23,26)