(2R)-3-(4-methylphenyl)-3-oxidanylidene-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)propanenitrile

Systemtic Name: (2R)-3-(4-methylphenyl)-3-oxidanylidene-2-(1-phenyl-1,2,3,4-tetrazol-5-yl)propanenitrile Openeye Name: (2R)-3-oxo-2-(1-phenyltetrazol-5-yl)-3-(p-tolyl)propanenitrile CAS Name: (2R)-3-(4-methylphenyl)-3-oxo-2-(1-phenyl-5-tetrazolyl)propanenitrile IUPAC Name: (2R)-3-(4-methylphenyl)-3-oxo-2-(1-phenyltetrazol-5-yl)propanenitrile Traditional Name: (2R)-3-keto-2-(1-phenyltetrazol-5-yl)-3-(p-tolyl)propionitrile Formula: C17H13N5O MolecularWeight: 303.31802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)C(C#N)C2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)[C@H](C#N)C2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C17H13N5O/c1-12-7-9-13(10-8-12)16(23)15(11-18)17-19-20-21-22(17)14-5-3-2-4-6-14/h2-10,15H,1H3/t15-/m0/s1