(2S)-1-(4-methoxyphenyl)sulfonyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrrolidine-2-carboxamide

Systemtic Name: (2S)-1-(4-methoxyphenyl)sulfonyl-N-[(3R)-1-(phenylmethyl)pyrrolidin-1-ium-3-yl]pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide CAS Name: (2S)-1-(4-methoxyphenyl)sulfonyl-N-[(3R)-1-(phenylmethyl)-3-pyrrolidin-1-iumyl]-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(4-methoxyphenyl)sulfonylpyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(3R)-1-benzylpyrrolidin-1-ium-3-yl]-1-(4-methoxyphenyl)sulfonyl-pyrrolidine-2-carboxamide Formula: C23H30N3O4S+ MolecularWeight: 444.567

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2C(=O)NC3CC[NH+](C3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H]2C(=O)N[C@@H]3CC[NH+](C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H29N3O4S/c1-30-20-9-11-21(12-10-20)31(28,29)26-14-5-8-22(26)23(27)24-19-13-15-25(17-19)16-18-6-3-2-4-7-18/h2-4,6-7,9-12,19,22H,5,8,13-17H2,1H3,(H,24,27)/p+1/t19-,22+/m1/s1