2-methoxyethyl-methyl-[(3S,4S)-4-oxidanyl-1-(phenylsulfonyl)pyrrolidin-3-yl]azanium

Systemtic Name: 2-methoxyethyl-methyl-[(3S,4S)-4-oxidanyl-1-(phenylsulfonyl)pyrrolidin-3-yl]azanium Openeye Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-pyrrolidin-3-yl]-(2-methoxyethyl)-methyl-ammonium CAS Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-3-pyrrolidinyl]-(2-methoxyethyl)-methylammonium IUPAC Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxypyrrolidin-3-yl]-(2-methoxyethyl)-methylazanium Traditional Name: [(3S,4S)-1-besyl-4-hydroxy-pyrrolidin-3-yl]-(2-methoxyethyl)-methyl-ammonium Formula: C14H23N2O4S+ MolecularWeight: 315.40842

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCOC)C1CN(CC1O)S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C[NH+](CCOC)[C@H]1CN(C[C@@H]1O)S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H22N2O4S/c1-15(8-9-20-2)13-10-16(11-14(13)17)21(18,19)12-6-4-3-5-7-12/h3-7,13-14,17H,8-11H2,1-2H3/p+1/t13-,14-/m0/s1