(2R)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide

Systemtic Name: (2R)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Openeye Name: (2R)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-morpholinosulfonylphenyl)propanamide CAS Name: (2R)-2-(5-ethyl-2-methyl-1-pyridin-1-iumyl)-N-[4-(4-morpholinylsulfonyl)phenyl]propanamide IUPAC Name: (2R)-2-(5-ethyl-2-methylpyridin-1-ium-1-yl)-N-(4-morpholin-4-ylsulfonylphenyl)propanamide Traditional Name: (2R)-2-(5-ethyl-2-methyl-pyridin-1-ium-1-yl)-N-(4-morpholinosulfonylphenyl)propionamide Formula: C21H28N3O4S+ MolecularWeight: 418.52972

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C[N+](=C(C=C1)C)C(C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CCC1=C[N+](=C(C=C1)C)[C@H](C)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C21H27N3O4S/c1-4-18-6-5-16(2)24(15-18)17(3)21(25)22-19-7-9-20(10-8-19)29(26,27)23-11-13-28-14-12-23/h5-10,15,17H,4,11-14H2,1-3H3/p+1/t17-/m1/s1