1-(4-methoxyphenyl)sulfonyl-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]piperidine-4-carboxamide

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-N-[[(2S)-4-(phenylmethyl)morpholin-4-ium-2-yl]methyl]piperidine-4-carboxamide Openeye Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(4-methoxyphenyl)sulfonyl-N-[[(2S)-4-(phenylmethyl)-2-morpholin-4-iumyl]methyl]-4-piperidinecarboxamide IUPAC Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[[(2S)-4-benzylmorpholin-4-ium-2-yl]methyl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NCC3C[NH+](CCO3)CC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC[C@H]3C[NH+](CCO3)CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3O5S/c1-32-22-7-9-24(10-8-22)34(30,31)28-13-11-21(12-14-28)25(29)26-17-23-19-27(15-16-33-23)18-20-5-3-2-4-6-20/h2-10,21,23H,11-19H2,1H3,(H,26,29)/p+1/t23-/m0/s1