(4-ethylpiperazin-4-ium-1-yl)-[1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[1-(4-methoxy-3-methyl-phenyl)sulfonylpiperidin-4-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[1-(4-methoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[1-(4-methoxy-3-methylphenyl)sulfonyl-4-piperidinyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[1-(4-methoxy-3-methylphenyl)sulfonylpiperidin-4-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[1-(4-methoxy-3-methyl-phenyl)sulfonyl-4-piperidyl]methanone Formula: C20H32N3O4S+ MolecularWeight: 410.55078

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)C

InChI

InChI=1S/C20H31N3O4S/c1-4-21-11-13-22(14-12-21)20(24)17-7-9-23(10-8-17)28(25,26)18-5-6-19(27-3)16(2)15-18/h5-6,15,17H,4,7-14H2,1-3H3/p+1