4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile

Systemtic Name: 4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-oxidanyl-propoxy]benzenecarbonitrile Openeye Name: 4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-hydroxy-propoxy]benzonitrile CAS Name: 4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]-2-hydroxypropoxy]benzonitrile IUPAC Name: 4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenylethyl]amino]-2-hydroxypropoxy]benzonitrile Traditional Name: 4-[(2R)-3-[[(2S)-2-(dimethylamino)-2-phenyl-ethyl]amino]-2-hydroxy-propoxy]benzonitrile Formula: C20H25N3O2 MolecularWeight: 339.4314

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(CNCC(COC1=CC=C(C=C1)C#N)O)C2=CC=CC=C2

Isomeric SMILES

CN(C)[C@H](CNC[C@H](COC1=CC=C(C=C1)C#N)O)C2=CC=CC=C2

InChI

InChI=1S/C20H25N3O2/c1-23(2)20(17-6-4-3-5-7-17)14-22-13-18(24)15-25-19-10-8-16(12-21)9-11-19/h3-11,18,20,22,24H,13-15H2,1-2H3/t18-,20-/m1/s1