(3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide

Systemtic Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide Openeye Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]piperidine-3-carboxamide CAS Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-(4-morpholin-4-iumyl)-1-phenylethyl]-3-piperidinecarboxamide IUPAC Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenylethyl]piperidine-3-carboxamide Traditional Name: (3R)-1-(4-methoxyphenyl)sulfonyl-N-[(1R)-2-morpholin-4-ium-4-yl-1-phenyl-ethyl]nipecotamide Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC(C2)C(=O)NC(C[NH+]3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC[C@H](C2)C(=O)N[C@@H](C[NH+]3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C25H33N3O5S/c1-32-22-9-11-23(12-10-22)34(30,31)28-13-5-8-21(18-28)25(29)26-24(20-6-3-2-4-7-20)19-27-14-16-33-17-15-27/h2-4,6-7,9-12,21,24H,5,8,13-19H2,1H3,(H,26,29)/p+1/t21-,24+/m1/s1