4-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide

Systemtic Name: 4-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-yl]carbonyl-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide Openeye Name: 4-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzenesulfonamide CAS Name: 4-[[4-[(4-ethoxyphenyl)methyl]-1-piperazin-4-iumyl]-oxomethyl]-N-[[(2R)-2-oxolanyl]methyl]benzenesulfonamide IUPAC Name: 4-[4-[(4-ethoxyphenyl)methyl]piperazin-4-ium-1-carbonyl]-N-[[(2R)-oxolan-2-yl]methyl]benzenesulfonamide Traditional Name: 4-[4-(4-ethoxybenzyl)piperazin-4-ium-1-carbonyl]-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzenesulfonamide Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NCC4CCCO4

Isomeric SMILES

CCOC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CC=C(C=C3)S(=O)(=O)NC[C@H]4CCCO4

InChI

InChI=1S/C25H33N3O5S/c1-2-32-22-9-5-20(6-10-22)19-27-13-15-28(16-14-27)25(29)21-7-11-24(12-8-21)34(30,31)26-18-23-4-3-17-33-23/h5-12,23,26H,2-4,13-19H2,1H3/p+1/t23-/m1/s1