N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-ium-1-yl]acetamide Formula: C17H24Cl2N3O3S+ MolecularWeight: 421.36176

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

C[C@H](C1CC1)NC(=O)C[NH+]2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C17H23Cl2N3O3S/c1-12(13-2-3-13)20-17(23)11-21-6-8-22(9-7-21)26(24,25)14-4-5-15(18)16(19)10-14/h4-5,10,12-13H,2-3,6-9,11H2,1H3,(H,20,23)/p+1/t12-/m1/s1