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

Systemtic Name: 4-chloranyl-N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-(4-dimethylaminophenyl)-1,3-benzoxazol-5-yl]-3-nitro-benzamide Formula: C22H17ClN4O4 MolecularWeight: 436.84778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H17ClN4O4/c1-26(2)16-7-3-13(4-8-16)22-25-18-12-15(6-10-20(18)31-22)24-21(28)14-5-9-17(23)19(11-14)27(29)30/h3-12H,1-2H3,(H,24,28)