4-[[3-(4-chlorophenyl)carbonyl-1-oxidanidyl-indazol-1-ium-2-yl]methyl]benzamide

Systemtic Name: 4-[[3-(4-chlorophenyl)carbonyl-1-oxidanidyl-indazol-1-ium-2-yl]methyl]benzamide Openeye Name: 4-[[3-(4-chlorobenzoyl)-1-oxido-indazol-1-ium-2-yl]methyl]benzamide CAS Name: 4-[[3-[(4-chlorophenyl)-oxomethyl]-1-oxido-2-indazol-1-iumyl]methyl]benzamide IUPAC Name: 4-[[3-(4-chlorobenzoyl)-1-oxidoindazol-1-ium-2-yl]methyl]benzamide Traditional Name: 4-[[3-(4-chlorobenzoyl)-1-oxido-indazol-1-ium-2-yl]methyl]benzamide Formula: C22H16ClN3O3 MolecularWeight: 405.83374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(N([N+](=C2C=C1)[O-])CC3=CC=C(C=C3)C(=O)N)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC2=C(N([N+](=C2C=C1)[O-])CC3=CC=C(C=C3)C(=O)N)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3O3/c23-17-11-9-15(10-12-17)21(27)20-18-3-1-2-4-19(18)26(29)25(20)13-14-5-7-16(8-6-14)22(24)28/h1-12H,13H2,(H2,24,28)