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

Systemtic Name: methyl-[(3-methylpyridin-2-yl)methyl]-[(3S,4S)-4-oxidanyl-1-(phenylsulfonyl)pyrrolidin-3-yl]azanium Openeye Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-pyrrolidin-3-yl]-methyl-[(3-methyl-2-pyridyl)methyl]ammonium CAS Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxy-3-pyrrolidinyl]-methyl-[(3-methyl-2-pyridinyl)methyl]ammonium IUPAC Name: [(3S,4S)-1-(benzenesulfonyl)-4-hydroxypyrrolidin-3-yl]-methyl-[(3-methylpyridin-2-yl)methyl]azanium Traditional Name: [(3S,4S)-1-besyl-4-hydroxy-pyrrolidin-3-yl]-methyl-[(3-methyl-2-pyridyl)methyl]ammonium Formula: C18H24N3O3S+ MolecularWeight: 362.46646

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)C[NH+](C)C2CN(CC2O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CC1=C(N=CC=C1)C[NH+](C)[C@H]2CN(C[C@@H]2O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C18H23N3O3S/c1-14-7-6-10-19-16(14)11-20(2)17-12-21(13-18(17)22)25(23,24)15-8-4-3-5-9-15/h3-10,17-18,22H,11-13H2,1-2H3/p+1/t17-,18-/m0/s1