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

Systemtic Name: N-ethyl-N-(phenylmethyl)-3-piperazin-4-ium-1-ylsulfonyl-propanamide Openeye Name: N-benzyl-N-ethyl-3-piperazin-4-ium-1-ylsulfonyl-propanamide CAS Name: N-ethyl-N-(phenylmethyl)-3-(1-piperazin-4-iumylsulfonyl)propanamide IUPAC Name: N-benzyl-N-ethyl-3-piperazin-4-ium-1-ylsulfonylpropanamide Traditional Name: N-benzyl-N-ethyl-3-piperazin-4-ium-1-ylsulfonyl-propionamide Formula: C16H26N3O3S+ MolecularWeight: 340.46094

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H25N3O3S/c1-2-18(14-15-6-4-3-5-7-15)16(20)8-13-23(21,22)19-11-9-17-10-12-19/h3-7,17H,2,8-14H2,1H3/p+1