(2S,7S)-2,7-bis[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino]octanedinitrile

Systemtic Name: (2S,7S)-2,7-bis[[(1R)-2-oxidanyl-1-phenyl-ethyl]amino]octanedinitrile Openeye Name: (2S,7S)-2,7-bis[[(1R)-2-hydroxy-1-phenyl-ethyl]amino]octanedinitrile CAS Name: (2S,7S)-2,7-bis[[(1R)-2-hydroxy-1-phenylethyl]amino]octanedinitrile IUPAC Name: (2S,7S)-2,7-bis[[(1R)-2-hydroxy-1-phenylethyl]amino]octanedinitrile Traditional Name: (2S,7S)-2,7-bis[[(1R)-2-hydroxy-1-phenyl-ethyl]amino]suberonitrile Formula: C24H30N4O2 MolecularWeight: 410.505684

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)NC(CCCCC(C#N)NC(CO)C2=CC=CC=C2)C#N

Isomeric SMILES

C1=CC=C(C=C1)[C@H](CO)N[C@@H](CCCC[C@@H]([14C]#N)N[C@@H](CO)C2=CC=CC=C2)[14C]#N

InChI

InChI=1S/C24H30N4O2/c25-15-21(27-23(17-29)19-9-3-1-4-10-19)13-7-8-14-22(16-26)28-24(18-30)20-11-5-2-6-12-20/h1-6,9-12,21-24,27-30H,7-8,13-14,17-18H2/t21-,22-,23-,24-/m0/s1/i15+2,16+2