2-bromanyl-4-[(2S,3S)-2-methyl-3-(2-oxidanylpropan-2-yl)pyrrolidin-1-yl]benzenecarbonitrile

Systemtic Name: 2-bromanyl-4-[(2S,3S)-2-methyl-3-(2-oxidanylpropan-2-yl)pyrrolidin-1-yl]benzenecarbonitrile Openeye Name: 2-bromo-4-[(2S,3S)-3-(1-hydroxy-1-methyl-ethyl)-2-methyl-pyrrolidin-1-yl]benzonitrile CAS Name: 2-bromo-4-[(2S,3S)-3-(2-hydroxypropan-2-yl)-2-methyl-1-pyrrolidinyl]benzonitrile IUPAC Name: 2-bromo-4-[(2S,3S)-3-(2-hydroxypropan-2-yl)-2-methylpyrrolidin-1-yl]benzonitrile Traditional Name: 2-bromo-4-[(2S,3S)-3-(1-hydroxy-1-methyl-ethyl)-2-methyl-pyrrolidino]benzonitrile Formula: C15H19BrN2O MolecularWeight: 323.22816

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCN1C2=CC(=C(C=C2)C#N)Br)C(C)(C)O

Isomeric SMILES

C[C@H]1[C@H](CCN1C2=CC(=C(C=C2)C#N)Br)C(C)(C)O

InChI

InChI=1S/C15H19BrN2O/c1-10-13(15(2,3)19)6-7-18(10)12-5-4-11(9-17)14(16)8-12/h4-5,8,10,13,19H,6-7H2,1-3H3/t10-,13-/m0/s1