N-(3,5-dimethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-(3,5-dimethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-(3,5-dimethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-(3,5-dimethylphenyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-(3,5-dimethylphenyl)-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-(3,5-dimethylphenyl)-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C15H24N3O3S+ MolecularWeight: 326.43436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=O)CCS(=O)(=O)N2CC[NH2+]CC2)C

InChI

InChI=1S/C15H23N3O3S/c1-12-9-13(2)11-14(10-12)17-15(19)3-8-22(20,21)18-6-4-16-5-7-18/h9-11,16H,3-8H2,1-2H3,(H,17,19)/p+1