(2S)-5-azanyl-3-oxidanylidene-2-(phenylmethyl)-1,2-dihydropyrrole-4-carbonitrile

Systemtic Name: (2S)-5-azanyl-3-oxidanylidene-2-(phenylmethyl)-1,2-dihydropyrrole-4-carbonitrile Openeye Name: (2S)-5-amino-2-benzyl-3-oxo-1,2-dihydropyrrole-4-carbonitrile CAS Name: (2S)-5-amino-3-oxo-2-(phenylmethyl)-1,2-dihydropyrrole-4-carbonitrile IUPAC Name: (2S)-5-amino-2-benzyl-3-oxo-1,2-dihydropyrrole-4-carbonitrile Traditional Name: (5S)-2-amino-5-benzyl-4-keto-2-pyrroline-3-carbonitrile Formula: C12H11N3O MolecularWeight: 213.23524

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2C(=O)C(=C(N2)N)C#N

Isomeric SMILES

C1=CC=C(C=C1)C[C@H]2C(=O)C(=C(N2)N)C#N

InChI

InChI=1S/C12H11N3O/c13-7-9-11(16)10(15-12(9)14)6-8-4-2-1-3-5-8/h1-5,10,15H,6,14H2/t10-/m0/s1