2-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: 2-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: 2-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]-5-morpholinosulfonyl-benzamide CAS Name: 2-methoxy-N-[4-[[(3S)-3-methyl-1-piperidin-1-iumyl]methyl]phenyl]-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: 2-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]-5-morpholin-4-ylsulfonylbenzamide Traditional Name: 2-methoxy-N-[4-[[(3S)-3-methylpiperidin-1-ium-1-yl]methyl]phenyl]-5-morpholinosulfonyl-benzamide Formula: C25H34N3O5S+ MolecularWeight: 488.61956

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

Isomeric SMILES

C[C@H]1CCC[NH+](C1)CC2=CC=C(C=C2)NC(=O)C3=C(C=CC(=C3)S(=O)(=O)N4CCOCC4)OC

InChI

InChI=1S/C25H33N3O5S/c1-19-4-3-11-27(17-19)18-20-5-7-21(8-6-20)26-25(29)23-16-22(9-10-24(23)32-2)34(30,31)28-12-14-33-15-13-28/h5-10,16,19H,3-4,11-15,17-18H2,1-2H3,(H,26,29)/p+1/t19-/m0/s1