N-aminocarbonyl-3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]propanamide

Systemtic Name: N-aminocarbonyl-3-[4-[2,6-bis(fluoranyl)phenyl]sulfonylpiperazin-1-ium-1-yl]propanamide Openeye Name: N-carbamoyl-3-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide CAS Name: N-carbamoyl-3-[4-(2,6-difluorophenyl)sulfonyl-1-piperazin-1-iumyl]propanamide IUPAC Name: N-carbamoyl-3-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]propanamide Traditional Name: N-carbamoyl-3-[4-(2,6-difluorophenyl)sulfonylpiperazin-1-ium-1-yl]propionamide Formula: C14H19F2N4O4S+ MolecularWeight: 377.386866

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCC(=O)NC(=O)N)S(=O)(=O)C2=C(C=CC=C2F)F

Isomeric SMILES

C1CN(CC[NH+]1CCC(=O)NC(=O)N)S(=O)(=O)C2=C(C=CC=C2F)F

InChI

InChI=1S/C14H18F2N4O4S/c15-10-2-1-3-11(16)13(10)25(23,24)20-8-6-19(7-9-20)5-4-12(21)18-14(17)22/h1-3H,4-9H2,(H3,17,18,21,22)/p+1