N-(3-fluorophenyl)-3-[4-[(2-oxidanylidene-1,3-dihydroindol-5-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide

Systemtic Name: N-(3-fluorophenyl)-3-[4-[(2-oxidanylidene-1,3-dihydroindol-5-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide Openeye Name: N-(3-fluorophenyl)-3-[4-(2-oxoindolin-5-yl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: N-(3-fluorophenyl)-3-[4-[(2-oxo-1,3-dihydroindol-5-yl)sulfonyl]-1-piperazin-1-iumyl]propanamide IUPAC Name: N-(3-fluorophenyl)-3-[4-[(2-oxo-1,3-dihydroindol-5-yl)sulfonyl]piperazin-1-ium-1-yl]propanamide Traditional Name: N-(3-fluorophenyl)-3-[4-(2-ketoindolin-5-yl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C21H24FN4O4S+ MolecularWeight: 447.503063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC2=CC(=CC=C2)F)S(=O)(=O)C3=CC4=C(C=C3)NC(=O)C4

InChI

InChI=1S/C21H23FN4O4S/c22-16-2-1-3-17(14-16)23-20(27)6-7-25-8-10-26(11-9-25)31(29,30)18-4-5-19-15(12-18)13-21(28)24-19/h1-5,12,14H,6-11,13H2,(H,23,27)(H,24,28)/p+1