5-(4-ethylpiperazin-4-ium-1-yl)carbonyl-2-methoxy-N-propyl-benzenesulfonamide

Systemtic Name: 5-(4-ethylpiperazin-4-ium-1-yl)carbonyl-2-methoxy-N-propyl-benzenesulfonamide Openeye Name: 5-(4-ethylpiperazin-4-ium-1-carbonyl)-2-methoxy-N-propyl-benzenesulfonamide CAS Name: 5-[(4-ethyl-1-piperazin-4-iumyl)-oxomethyl]-2-methoxy-N-propylbenzenesulfonamide IUPAC Name: 5-(4-ethylpiperazin-4-ium-1-carbonyl)-2-methoxy-N-propylbenzenesulfonamide Traditional Name: 5-(4-ethylpiperazin-4-ium-1-carbonyl)-2-methoxy-N-propyl-benzenesulfonamide Formula: C17H28N3O4S+ MolecularWeight: 370.48692

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Descriptors Computed from Structure

Canonical SMILES:

CCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)CC)OC

Isomeric SMILES

CCCNS(=O)(=O)C1=C(C=CC(=C1)C(=O)N2CC[NH+](CC2)CC)OC

InChI

InChI=1S/C17H27N3O4S/c1-4-8-18-25(22,23)16-13-14(6-7-15(16)24-3)17(21)20-11-9-19(5-2)10-12-20/h6-7,13,18H,4-5,8-12H2,1-3H3/p+1