(2S)-2-(1H-benzimidazol-2-yl)-2-[(2,4-dimethoxyphenyl)methyl]-3-oxidanyl-propanenitrile

Systemtic Name: (2S)-2-(1H-benzimidazol-2-yl)-2-[(2,4-dimethoxyphenyl)methyl]-3-oxidanyl-propanenitrile Openeye Name: (2S)-2-(1H-benzimidazol-2-yl)-2-[(2,4-dimethoxyphenyl)methyl]-3-hydroxy-propanenitrile CAS Name: (2S)-2-(1H-benzimidazol-2-yl)-2-[(2,4-dimethoxyphenyl)methyl]-3-hydroxypropanenitrile IUPAC Name: (2S)-2-(1H-benzimidazol-2-yl)-2-[(2,4-dimethoxyphenyl)methyl]-3-hydroxypropanenitrile Traditional Name: (2S)-2-(1H-benzimidazol-2-yl)-2-(2,4-dimethoxybenzyl)-3-hydroxy-propionitrile Formula: C19H19N3O3 MolecularWeight: 337.37246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)CC(CO)(C#N)C2=NC3=CC=CC=C3N2)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C[C@](CO)(C#N)C2=NC3=CC=CC=C3N2)OC

InChI

InChI=1S/C19H19N3O3/c1-24-14-8-7-13(17(9-14)25-2)10-19(11-20,12-23)18-21-15-5-3-4-6-16(15)22-18/h3-9,23H,10,12H2,1-2H3,(H,21,22)/t19-/m1/s1