3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide CAS Name: 3-[4-(1H-indol-3-yl)-1-piperidin-1-iumyl]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propanamide Traditional Name: 3-[4-(1H-indol-3-yl)piperidin-1-ium-1-yl]-N-(4-nitrophenyl)propionamide Formula: C22H25N4O3+ MolecularWeight: 393.4589

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1C[NH+](CCC1C2=CNC3=CC=CC=C32)CCC(=O)NC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H24N4O3/c27-22(24-17-5-7-18(8-6-17)26(28)29)11-14-25-12-9-16(10-13-25)20-15-23-21-4-2-1-3-19(20)21/h1-8,15-16,23H,9-14H2,(H,24,27)/p+1