3-[6-methoxy-3-(4-methylphenyl)carbonyl-1-oxidanidyl-indazol-1-ium-2-yl]propanamide

Systemtic Name: 3-[6-methoxy-3-(4-methylphenyl)carbonyl-1-oxidanidyl-indazol-1-ium-2-yl]propanamide Openeye Name: 3-[6-methoxy-3-(4-methylbenzoyl)-1-oxido-indazol-1-ium-2-yl]propanamide CAS Name: 3-[6-methoxy-3-[(4-methylphenyl)-oxomethyl]-1-oxido-2-indazol-1-iumyl]propanamide IUPAC Name: 3-[6-methoxy-3-(4-methylbenzoyl)-1-oxidoindazol-1-ium-2-yl]propanamide Traditional Name: 3-(6-methoxy-1-oxido-3-p-toluoyl-indazol-1-ium-2-yl)propionamide Formula: C19H19N3O4 MolecularWeight: 353.37186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C2=C3C=CC(=CC3=[N+](N2CCC(=O)N)[O-])OC

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)C2=C3C=CC(=CC3=[N+](N2CCC(=O)N)[O-])OC

InChI

InChI=1S/C19H19N3O4/c1-12-3-5-13(6-4-12)19(24)18-15-8-7-14(26-2)11-16(15)22(25)21(18)10-9-17(20)23/h3-8,11H,9-10H2,1-2H3,(H2,20,23)