3-chloranyl-2-methyl-5-(4-propylpiperazin-4-ium-1-yl)sulfonyl-aniline

Systemtic Name: 3-chloranyl-2-methyl-5-(4-propylpiperazin-4-ium-1-yl)sulfonyl-aniline Openeye Name: 3-chloro-2-methyl-5-(4-propylpiperazin-4-ium-1-yl)sulfonyl-aniline CAS Name: 3-chloro-2-methyl-5-[(4-propyl-1-piperazin-4-iumyl)sulfonyl]aniline IUPAC Name: 3-chloro-2-methyl-5-(4-propylpiperazin-4-ium-1-yl)sulfonylaniline Traditional Name: [3-chloro-2-methyl-5-(4-propylpiperazin-4-ium-1-yl)sulfonyl-phenyl]amine Formula: C14H23ClN3O2S+ MolecularWeight: 332.86932

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)N)C)Cl

Isomeric SMILES

CCC[NH+]1CCN(CC1)S(=O)(=O)C2=CC(=C(C(=C2)N)C)Cl

InChI

InChI=1S/C14H22ClN3O2S/c1-3-4-17-5-7-18(8-6-17)21(19,20)12-9-13(15)11(2)14(16)10-12/h9-10H,3-8,16H2,1-2H3/p+1