(E,4S)-2-[methyl-[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]amino]-4-phenyl-hex-2-enenitrile

Systemtic Name: (E,4S)-2-[methyl-[(1R,2S)-1-oxidanyl-1-phenyl-propan-2-yl]amino]-4-phenyl-hex-2-enenitrile Openeye Name: (E,4S)-2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]-methyl-amino]-4-phenyl-hex-2-enenitrile CAS Name: (E,4S)-2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]-4-phenyl-2-hexenenitrile IUPAC Name: (E,4S)-2-[[(1R,2S)-1-hydroxy-1-phenylpropan-2-yl]-methylamino]-4-phenylhex-2-enenitrile Traditional Name: (E,4S)-2-[[(1S,2R)-2-hydroxy-1-methyl-2-phenyl-ethyl]-methyl-amino]-4-phenyl-hex-2-enenitrile Formula: C22H26N2O MolecularWeight: 334.45464

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C=C(C#N)N(C)C(C)C(C1=CC=CC=C1)O)C2=CC=CC=C2

Isomeric SMILES

CC[C@@H](/C=C(\C#N)/N(C)[C@@H](C)[C@@H](C1=CC=CC=C1)O)C2=CC=CC=C2

InChI

InChI=1S/C22H26N2O/c1-4-18(19-11-7-5-8-12-19)15-21(16-23)24(3)17(2)22(25)20-13-9-6-10-14-20/h5-15,17-18,22,25H,4H2,1-3H3/b21-15+/t17-,18-,22-/m0/s1