5-chloranyl-3-[(3-cyano-5-methyl-phenyl)-methoxy-phosphoryl]-N-[(2-oxidanidylpyridazin-2-ium-4-yl)methyl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-3-[(3-cyano-5-methyl-phenyl)-methoxy-phosphoryl]-N-[(2-oxidanidylpyridazin-2-ium-4-yl)methyl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-3-[(3-cyano-5-methyl-phenyl)-methoxy-phosphoryl]-N-[(2-oxidopyridazin-2-ium-4-yl)methyl]-1H-indole-2-carboxamide CAS Name: 5-chloro-3-[(3-cyano-5-methylphenyl)-methoxyphosphoryl]-N-[(2-oxido-4-pyridazin-2-iumyl)methyl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-3-[(3-cyano-5-methylphenyl)-methoxyphosphoryl]-N-[(2-oxidopyridazin-2-ium-4-yl)methyl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-3-[(3-cyano-5-methyl-phenyl)-methoxy-phosphoryl]-N-[(2-oxidopyridazin-2-ium-4-yl)methyl]-1H-indole-2-carboxamide Formula: C23H19ClN5O4P MolecularWeight: 495.854821

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C#N)P(=O)(C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=C[N+](=NC=C4)[O-])OC

Isomeric SMILES

CC1=CC(=CC(=C1)C#N)P(=O)(C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=C[N+](=NC=C4)[O-])OC

InChI

InChI=1S/C23H19ClN5O4P/c1-14-7-16(11-25)9-18(8-14)34(32,33-2)22-19-10-17(24)3-4-20(19)28-21(22)23(30)26-12-15-5-6-27-29(31)13-15/h3-10,13,28H,12H2,1-2H3,(H,26,30)