N-methyl-N-phenyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide

Systemtic Name: N-methyl-N-phenyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-methyl-N-phenyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-methyl-N-phenyl-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-methyl-N-phenyl-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-methyl-N-phenyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3O3S/c1-16(13-5-3-2-4-6-13)14(18)7-12-21(19,20)17-10-8-15-9-11-17/h2-6,15H,7-12H2,1H3/p+1