(2R,5S)-2-heptyl-5-(iodanylmethyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine

Systemtic Name: (2R,5S)-2-heptyl-5-(iodanylmethyl)-1-(4-methylphenyl)sulfonyl-pyrrolidine Openeye Name: (2R,5S)-2-heptyl-5-(iodomethyl)-1-(p-tolylsulfonyl)pyrrolidine CAS Name: (2R,5S)-2-heptyl-5-(iodomethyl)-1-(4-methylphenyl)sulfonylpyrrolidine IUPAC Name: (2R,5S)-2-heptyl-5-(iodomethyl)-1-(4-methylphenyl)sulfonylpyrrolidine Traditional Name: (2R,5S)-2-heptyl-5-(iodomethyl)-1-tosyl-pyrrolidine Formula: C19H30INO2S MolecularWeight: 463.41647

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1CCC(N1S(=O)(=O)C2=CC=C(C=C2)C)CI

Isomeric SMILES

CCCCCCC[C@@H]1CC[C@H](N1S(=O)(=O)C2=CC=C(C=C2)C)CI

InChI

InChI=1S/C19H30INO2S/c1-3-4-5-6-7-8-17-11-12-18(15-20)21(17)24(22,23)19-13-9-16(2)10-14-19/h9-10,13-14,17-18H,3-8,11-12,15H2,1-2H3/t17-,18+/m1/s1