N-methyl-N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H23N3O3S/c1-17(13-14-5-3-2-4-6-14)15(19)7-12-22(20,21)18-10-8-16-9-11-18/h2-6,16H,7-13H2,1H3/p+1