1-(4-methylphenyl)sulfonyl-3-(2-pyrrolidin-1-ium-1-ylethyl)urea

Systemtic Name: 1-(4-methylphenyl)sulfonyl-3-(2-pyrrolidin-1-ium-1-ylethyl)urea Openeye Name: 1-(p-tolylsulfonyl)-3-(2-pyrrolidin-1-ium-1-ylethyl)urea CAS Name: 1-(4-methylphenyl)sulfonyl-3-[2-(1-pyrrolidin-1-iumyl)ethyl]urea IUPAC Name: 1-(4-methylphenyl)sulfonyl-3-(2-pyrrolidin-1-ium-1-ylethyl)urea Traditional Name: 1-(2-pyrrolidin-1-ium-1-ylethyl)-3-tosyl-urea Formula: C14H22N3O3S+ MolecularWeight: 312.40778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NCC[NH+]2CCCC2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(=O)NCC[NH+]2CCCC2

InChI

InChI=1S/C14H21N3O3S/c1-12-4-6-13(7-5-12)21(19,20)16-14(18)15-8-11-17-9-2-3-10-17/h4-7H,2-3,8-11H2,1H3,(H2,15,16,18)/p+1