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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NC2=CC3=C(C=C2)OC(=N3)CC4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H17N3O4/c1-14-11-16(7-9-19(14)25(27)28)22(26)23-17-8-10-20-18(13-17)24-21(29-20)12-15-5-3-2-4-6-15/h2-11,13H,12H2,1H3,(H,23,26)