ethyl-[(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)methyl]-(phenylmethyl)azanium

Systemtic Name: ethyl-[(2-oxidanylidene-5-pyrrolidin-1-ylsulfonyl-pyridin-1-yl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-ethyl-[(2-oxo-5-pyrrolidin-1-ylsulfonyl-1-pyridyl)methyl]ammonium CAS Name: ethyl-[[2-oxo-5-(1-pyrrolidinylsulfonyl)-1-pyridinyl]methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-ethyl-[(2-oxo-5-pyrrolidin-1-ylsulfonylpyridin-1-yl)methyl]azanium Traditional Name: benzyl-ethyl-[(2-keto-5-pyrrolidinosulfonyl-1-pyridyl)methyl]ammonium Formula: C19H26N3O3S+ MolecularWeight: 376.49304

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CC=C1)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC[NH+](CC1=CC=CC=C1)CN2C=C(C=CC2=O)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H25N3O3S/c1-2-20(14-17-8-4-3-5-9-17)16-21-15-18(10-11-19(21)23)26(24,25)22-12-6-7-13-22/h3-5,8-11,15H,2,6-7,12-14,16H2,1H3/p+1