(2R)-2-(3-ethanoylpyridin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: (2R)-2-(3-ethanoylpyridin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-(3-acetylpyridin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide CAS Name: (2R)-2-(3-acetyl-1-pyridin-1-iumyl)-N-[4-(1-pyrrolidinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-(3-acetylpyridin-1-ium-1-yl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-(3-acetylpyridin-1-ium-1-yl)-N-(4-pyrrolidinosulfonylphenyl)propionamide Formula: C20H24N3O4S+ MolecularWeight: 402.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[N+]3=CC=CC(=C3)C(=O)C

Isomeric SMILES

C[C@H](C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCCC2)[N+]3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C20H23N3O4S/c1-15(22-11-5-6-17(14-22)16(2)24)20(25)21-18-7-9-19(10-8-18)28(26,27)23-12-3-4-13-23/h5-11,14-15H,3-4,12-13H2,1-2H3/p+1/t15-/m1/s1