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

Systemtic Name: 2-chloranyl-3-methyl-4-[(2S,3S)-2-methyl-3-(2-oxidanylpropan-2-yl)pyrrolidin-1-yl]benzenecarbonitrile Openeye Name: 2-chloro-4-[(2S,3S)-3-(1-hydroxy-1-methyl-ethyl)-2-methyl-pyrrolidin-1-yl]-3-methyl-benzonitrile CAS Name: 2-chloro-4-[(2S,3S)-3-(2-hydroxypropan-2-yl)-2-methyl-1-pyrrolidinyl]-3-methylbenzonitrile IUPAC Name: 2-chloro-4-[(2S,3S)-3-(2-hydroxypropan-2-yl)-2-methylpyrrolidin-1-yl]-3-methylbenzonitrile Traditional Name: 2-chloro-4-[(2S,3S)-3-(1-hydroxy-1-methyl-ethyl)-2-methyl-pyrrolidino]-3-methyl-benzonitrile Formula: C16H21ClN2O MolecularWeight: 292.80374

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(CCN1C2=C(C(=C(C=C2)C#N)Cl)C)C(C)(C)O

Isomeric SMILES

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

InChI

InChI=1S/C16H21ClN2O/c1-10-14(6-5-12(9-18)15(10)17)19-8-7-13(11(19)2)16(3,4)20/h5-6,11,13,20H,7-8H2,1-4H3/t11-,13-/m0/s1