3-phenyl-N-(2-piperazin-4-ium-1-ylsulfonylethyl)propanamide

Systemtic Name: 3-phenyl-N-(2-piperazin-4-ium-1-ylsulfonylethyl)propanamide Openeye Name: 3-phenyl-N-(2-piperazin-4-ium-1-ylsulfonylethyl)propanamide CAS Name: 3-phenyl-N-[2-(1-piperazin-4-iumylsulfonyl)ethyl]propanamide IUPAC Name: 3-phenyl-N-(2-piperazin-4-ium-1-ylsulfonylethyl)propanamide Traditional Name: 3-phenyl-N-(2-piperazin-4-ium-1-ylsulfonylethyl)propionamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)CCC2=CC=CC=C2

Isomeric SMILES

C1CN(CC[NH2+]1)S(=O)(=O)CCNC(=O)CCC2=CC=CC=C2

InChI

InChI=1S/C15H23N3O3S/c19-15(7-6-14-4-2-1-3-5-14)17-10-13-22(20,21)18-11-8-16-9-12-18/h1-5,16H,6-13H2,(H,17,19)/p+1