(2S)-2-[(4-nitrophenyl)methyl]-3-oxidanylidene-2-phenyl-butanenitrile

Systemtic Name: (2S)-2-[(4-nitrophenyl)methyl]-3-oxidanylidene-2-phenyl-butanenitrile Openeye Name: (2S)-2-[(4-nitrophenyl)methyl]-3-oxo-2-phenyl-butanenitrile CAS Name: (2S)-2-[(4-nitrophenyl)methyl]-3-oxo-2-phenylbutanenitrile IUPAC Name: (2S)-2-[(4-nitrophenyl)methyl]-3-oxo-2-phenylbutanenitrile Traditional Name: (2S)-3-keto-2-(4-nitrobenzyl)-2-phenyl-butyronitrile Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(CC1=CC=C(C=C1)[N+](=O)[O-])(C#N)C2=CC=CC=C2

Isomeric SMILES

CC(=O)[C@](CC1=CC=C(C=C1)[N+](=O)[O-])(C#N)C2=CC=CC=C2

InChI

InChI=1S/C17H14N2O3/c1-13(20)17(12-18,15-5-3-2-4-6-15)11-14-7-9-16(10-8-14)19(21)22/h2-10H,11H2,1H3/t17-/m0/s1