[(3R,4S)-1-(4-methylphenyl)sulfonyl-4-phenyl-pyrrolidin-3-yl] ethanoate

Systemtic Name: [(3R,4S)-1-(4-methylphenyl)sulfonyl-4-phenyl-pyrrolidin-3-yl] ethanoate Openeye Name: [(3R,4S)-4-phenyl-1-(p-tolylsulfonyl)pyrrolidin-3-yl] acetate CAS Name: acetic acid [(3R,4S)-1-(4-methylphenyl)sulfonyl-4-phenyl-3-pyrrolidinyl] ester IUPAC Name: [(3R,4S)-1-(4-methylphenyl)sulfonyl-4-phenylpyrrolidin-3-yl] acetate Traditional Name: acetic acid [(3R,4S)-4-phenyl-1-tosyl-pyrrolidin-3-yl] ester Formula: C19H21NO4S MolecularWeight: 359.43934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(C(C2)OC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H]([C@H](C2)OC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C19H21NO4S/c1-14-8-10-17(11-9-14)25(22,23)20-12-18(16-6-4-3-5-7-16)19(13-20)24-15(2)21/h3-11,18-19H,12-13H2,1-2H3/t18-,19+/m1/s1