[(S)-cyano-(4-phenylmethoxyphenyl)methyl]-(phenylmethyl)azanium

Systemtic Name: [(S)-cyano-(4-phenylmethoxyphenyl)methyl]-(phenylmethyl)azanium Openeye Name: benzyl-[(S)-(4-benzyloxyphenyl)-cyano-methyl]ammonium CAS Name: [(S)-cyano-(4-phenylmethoxyphenyl)methyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-[(S)-cyano-(4-phenylmethoxyphenyl)methyl]azanium Traditional Name: [(S)-(4-benzoxyphenyl)-cyano-methyl]-benzyl-ammonium Formula: C22H21N2O+ MolecularWeight: 329.41494

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C[NH2+]C(C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C[NH2+][C@H](C#N)C2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C22H20N2O/c23-15-22(24-16-18-7-3-1-4-8-18)20-11-13-21(14-12-20)25-17-19-9-5-2-6-10-19/h1-14,22,24H,16-17H2/p+1/t22-/m1/s1