2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide

Systemtic Name: 2-[(4-chlorophenyl)sulfonyl-methyl-amino]-N-[(3S)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]ethanamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetamide CAS Name: 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-[(3S)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]acetamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorophenyl)sulfonyl-methylamino]acetamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-1-ium-3-yl]-2-[(4-chlorophenyl)sulfonyl-methyl-amino]acetamide Formula: C20H25ClN3O3S+ MolecularWeight: 422.9488

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)NC1CC[NH+](C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CN(CC(=O)N[C@H]1CC[NH+](C1)CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H24ClN3O3S/c1-23(28(26,27)19-9-7-17(21)8-10-19)15-20(25)22-18-11-12-24(14-18)13-16-5-3-2-4-6-16/h2-10,18H,11-15H2,1H3,(H,22,25)/p+1/t18-/m0/s1