[1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [1-(2-methoxy-5-methyl-phenyl)sulfonylpiperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Openeye Name: [1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]-(4-methylpiperazin-4-ium-1-yl)methanone CAS Name: [1-(2-methoxy-5-methylphenyl)sulfonyl-4-piperidinyl]-(4-methyl-1-piperazin-4-iumyl)methanone IUPAC Name: [1-(2-methoxy-5-methylphenyl)sulfonylpiperidin-4-yl]-(4-methylpiperazin-4-ium-1-yl)methanone Traditional Name: [1-(2-methoxy-5-methyl-phenyl)sulfonyl-4-piperidyl]-(4-methylpiperazin-4-ium-1-yl)methanone Formula: C19H30N3O4S+ MolecularWeight: 396.5242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)N3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC(=C(C=C1)OC)S(=O)(=O)N2CCC(CC2)C(=O)N3CC[NH+](CC3)C

InChI

InChI=1S/C19H29N3O4S/c1-15-4-5-17(26-3)18(14-15)27(24,25)22-8-6-16(7-9-22)19(23)21-12-10-20(2)11-13-21/h4-5,14,16H,6-13H2,1-3H3/p+1