[(2S,4R,5S)-4-iodanyl-1-(4-methylphenyl)sulfonyl-5-phenyl-pyrrolidin-2-yl]methanol

Systemtic Name: [(2S,4R,5S)-4-iodanyl-1-(4-methylphenyl)sulfonyl-5-phenyl-pyrrolidin-2-yl]methanol Openeye Name: [(2S,4R,5S)-4-iodo-5-phenyl-1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanol CAS Name: [(2S,4R,5S)-4-iodo-1-(4-methylphenyl)sulfonyl-5-phenyl-2-pyrrolidinyl]methanol IUPAC Name: [(2S,4R,5S)-4-iodo-1-(4-methylphenyl)sulfonyl-5-phenylpyrrolidin-2-yl]methanol Traditional Name: [(2S,4R,5S)-4-iodo-5-phenyl-1-tosyl-pyrrolidin-2-yl]methanol Formula: C18H20INO3S MolecularWeight: 457.32577

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C(CC(C2C3=CC=CC=C3)I)CO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H](C[C@H]([C@@H]2C3=CC=CC=C3)I)CO

InChI

InChI=1S/C18H20INO3S/c1-13-7-9-16(10-8-13)24(22,23)20-15(12-21)11-17(19)18(20)14-5-3-2-4-6-14/h2-10,15,17-18,21H,11-12H2,1H3/t15-,17+,18-/m0/s1