N-(4-ethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(4-ethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(4-ethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(4-ethylphenyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(4-ethylphenyl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(4-ethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C15H23N3O3S/c1-2-13-3-5-14(6-4-13)17-15(19)7-12-22(20,21)18-10-8-16-9-11-18/h3-6,16H,2,7-12H2,1H3,(H,17,19)/p+1