N-[1-[(4-methylphenyl)methyl]pyridin-1-ium-2-yl]-3-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide

Systemtic Name: N-[1-[(4-methylphenyl)methyl]pyridin-1-ium-2-yl]-3-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide Openeye Name: N-[1-(p-tolylmethyl)pyridin-1-ium-2-yl]-3-[[(2R)-tetrahydrofuran-2-yl]methylsulfamoyl]benzamide CAS Name: N-[1-[(4-methylphenyl)methyl]-2-pyridin-1-iumyl]-3-[[(2R)-2-oxolanyl]methylsulfamoyl]benzamide IUPAC Name: N-[1-[(4-methylphenyl)methyl]pyridin-1-ium-2-yl]-3-[[(2R)-oxolan-2-yl]methylsulfamoyl]benzamide Traditional Name: N-[1-(4-methylbenzyl)pyridin-1-ium-2-yl]-3-[[(2R)-tetrahydrofuran-2-yl]methylsulfamoyl]benzamide Formula: C25H28N3O4S+ MolecularWeight: 466.57252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[N+]2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)NCC4CCCO4

Isomeric SMILES

CC1=CC=C(C=C1)C[N+]2=CC=CC=C2NC(=O)C3=CC(=CC=C3)S(=O)(=O)NC[C@H]4CCCO4

InChI

InChI=1S/C25H27N3O4S/c1-19-10-12-20(13-11-19)18-28-14-3-2-9-24(28)27-25(29)21-6-4-8-23(16-21)33(30,31)26-17-22-7-5-15-32-22/h2-4,6,8-14,16,22,26H,5,7,15,17-18H2,1H3/p+1/t22-/m1/s1