(2R,3S)-3,4-bis(phenylmethoxy)-2-[(phenylmethyl)amino]butanenitrile

Systemtic Name: (2R,3S)-3,4-bis(phenylmethoxy)-2-[(phenylmethyl)amino]butanenitrile Openeye Name: (2R,3S)-2-(benzylamino)-3,4-dibenzyloxy-butanenitrile CAS Name: (2R,3S)-3,4-bis(phenylmethoxy)-2-[(phenylmethyl)amino]butanenitrile IUPAC Name: (2R,3S)-2-(benzylamino)-3,4-bis(phenylmethoxy)butanenitrile Traditional Name: (2R,3S)-3,4-dibenzoxy-2-(benzylamino)butyronitrile Formula: C25H26N2O2 MolecularWeight: 386.48614

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(C#N)C(COCC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CN[C@H](C#N)[C@@H](COCC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O2/c26-16-24(27-17-21-10-4-1-5-11-21)25(29-19-23-14-8-3-9-15-23)20-28-18-22-12-6-2-7-13-22/h1-15,24-25,27H,17-20H2/t24-,25-/m1/s1