2-chloranyl-N-[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]-5-nitro-benzamide CAS Name: 2-chloro-N-[2-(4-ethylphenyl)-6-methyl-5-benzotriazolyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[2-(4-ethylphenyl)-6-methylbenzotriazol-5-yl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-(4-ethylphenyl)-6-methyl-benzotriazol-5-yl]-5-nitro-benzamide Formula: C22H18ClN5O3 MolecularWeight: 435.86302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)N2N=C3C=C(C(=CC3=N2)NC(=O)C4=C(C=CC(=C4)[N+](=O)[O-])Cl)C

InChI

InChI=1S/C22H18ClN5O3/c1-3-14-4-6-15(7-5-14)27-25-20-10-13(2)19(12-21(20)26-27)24-22(29)17-11-16(28(30)31)8-9-18(17)23/h4-12H,3H2,1-2H3,(H,24,29)