5-chloranyl-3-[(3,5-dicyanophenyl)-methoxy-phosphoryl]-N-[(1-oxidanidylpyrimidin-1-ium-5-yl)methyl]-1H-indole-2-carboxamide

Systemtic Name: 5-chloranyl-3-[(3,5-dicyanophenyl)-methoxy-phosphoryl]-N-[(1-oxidanidylpyrimidin-1-ium-5-yl)methyl]-1H-indole-2-carboxamide Openeye Name: 5-chloro-3-[(3,5-dicyanophenyl)-methoxy-phosphoryl]-N-[(1-oxidopyrimidin-1-ium-5-yl)methyl]-1H-indole-2-carboxamide CAS Name: 5-chloro-3-[(3,5-dicyanophenyl)-methoxyphosphoryl]-N-[(1-oxido-5-pyrimidin-1-iumyl)methyl]-1H-indole-2-carboxamide IUPAC Name: 5-chloro-3-[(3,5-dicyanophenyl)-methoxyphosphoryl]-N-[(1-oxidopyrimidin-1-ium-5-yl)methyl]-1H-indole-2-carboxamide Traditional Name: 5-chloro-3-[(3,5-dicyanophenyl)-methoxy-phosphoryl]-N-[(1-oxidopyrimidin-1-ium-5-yl)methyl]-1H-indole-2-carboxamide Formula: C23H16ClN6O4P MolecularWeight: 506.837701

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C1=CC(=CC(=C1)C#N)C#N)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CN=C[N+](=C4)[O-]

Isomeric SMILES

COP(=O)(C1=CC(=CC(=C1)C#N)C#N)C2=C(NC3=C2C=C(C=C3)Cl)C(=O)NCC4=CN=C[N+](=C4)[O-]

InChI

InChI=1S/C23H16ClN6O4P/c1-34-35(33,18-5-14(8-25)4-15(6-18)9-26)22-19-7-17(24)2-3-20(19)29-21(22)23(31)28-11-16-10-27-13-30(32)12-16/h2-7,10,12-13,29H,11H2,1H3,(H,28,31)