3-[tert-butyl-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]propanenitrile

Systemtic Name: 3-[tert-butyl-[(2S)-2-(4-methoxyphenyl)-2-oxidanyl-ethyl]amino]propanenitrile Openeye Name: 3-[tert-butyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propanenitrile CAS Name: 3-[tert-butyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propanenitrile IUPAC Name: 3-[tert-butyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propanenitrile Traditional Name: 3-[tert-butyl-[(2S)-2-hydroxy-2-(4-methoxyphenyl)ethyl]amino]propionitrile Formula: C16H24N2O2 MolecularWeight: 276.37396

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)N(CCC#N)CC(C1=CC=C(C=C1)OC)O

Isomeric SMILES

CC(C)(C)N(CCC#N)C[C@H](C1=CC=C(C=C1)OC)O

InChI

InChI=1S/C16H24N2O2/c1-16(2,3)18(11-5-10-17)12-15(19)13-6-8-14(20-4)9-7-13/h6-9,15,19H,5,11-12H2,1-4H3/t15-/m1/s1