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

Systemtic Name: 4-chloranyl-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide Openeye Name: 4-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide CAS Name: 4-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide IUPAC Name: 4-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-3-nitrobenzamide Traditional Name: 4-chloro-N-[2-[4-(diethylamino)phenyl]-1,3-benzoxazol-5-yl]-3-nitro-benzamide Formula: C24H21ClN4O4 MolecularWeight: 464.90094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)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

CCN(CC)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/C24H21ClN4O4/c1-3-28(4-2)18-9-5-15(6-10-18)24-27-20-14-17(8-12-22(20)33-24)26-23(30)16-7-11-19(25)21(13-16)29(31)32/h5-14H,3-4H2,1-2H3,(H,26,30)