4-morpholin-4-ylsulfonyl-N-(pyridin-1-ium-3-ylmethyl)benzamide

Systemtic Name: 4-morpholin-4-ylsulfonyl-N-(pyridin-1-ium-3-ylmethyl)benzamide Openeye Name: 4-morpholinosulfonyl-N-(pyridin-1-ium-3-ylmethyl)benzamide CAS Name: 4-(4-morpholinylsulfonyl)-N-(3-pyridin-1-iumylmethyl)benzamide IUPAC Name: 4-morpholin-4-ylsulfonyl-N-(pyridin-1-ium-3-ylmethyl)benzamide Traditional Name: 4-morpholinosulfonyl-N-(pyridin-1-ium-3-ylmethyl)benzamide Formula: C17H20N3O4S+ MolecularWeight: 362.4234

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C[NH+]=CC=C3

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC3=C[NH+]=CC=C3

InChI

InChI=1S/C17H19N3O4S/c21-17(19-13-14-2-1-7-18-12-14)15-3-5-16(6-4-15)25(22,23)20-8-10-24-11-9-20/h1-7,12H,8-11,13H2,(H,19,21)/p+1