(2S,4R)-4-bromanyl-1-(4-methylphenyl)sulfonyl-2-(4-nitrophenyl)pyrrolidine

Systemtic Name: (2S,4R)-4-bromanyl-1-(4-methylphenyl)sulfonyl-2-(4-nitrophenyl)pyrrolidine Openeye Name: (2S,4R)-4-bromo-2-(4-nitrophenyl)-1-(p-tolylsulfonyl)pyrrolidine CAS Name: (2S,4R)-4-bromo-1-(4-methylphenyl)sulfonyl-2-(4-nitrophenyl)pyrrolidine IUPAC Name: (2S,4R)-4-bromo-1-(4-methylphenyl)sulfonyl-2-(4-nitrophenyl)pyrrolidine Traditional Name: (2S,4R)-4-bromo-2-(4-nitrophenyl)-1-tosyl-pyrrolidine Formula: C17H17BrN2O4S MolecularWeight: 425.29688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(CC2C3=CC=C(C=C3)[N+](=O)[O-])Br

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C[C@@H](C[C@H]2C3=CC=C(C=C3)[N+](=O)[O-])Br

InChI

InChI=1S/C17H17BrN2O4S/c1-12-2-8-16(9-3-12)25(23,24)19-11-14(18)10-17(19)13-4-6-15(7-5-13)20(21)22/h2-9,14,17H,10-11H2,1H3/t14-,17+/m1/s1