5-nitro-2-[(2-oxidanyl-2-phenyl-ethyl)amino]benzenecarbonitrile

Systemtic Name: 5-nitro-2-[(2-oxidanyl-2-phenyl-ethyl)amino]benzenecarbonitrile Openeye Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-5-nitro-benzonitrile CAS Name: 2-[(2-hydroxy-2-phenylethyl)amino]-5-nitrobenzonitrile IUPAC Name: 2-[(2-hydroxy-2-phenylethyl)amino]-5-nitrobenzonitrile Traditional Name: 2-[(2-hydroxy-2-phenyl-ethyl)amino]-5-nitro-benzonitrile Formula: C15H13N3O3 MolecularWeight: 283.28202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)O

Isomeric SMILES

C1=CC=C(C=C1)C(CNC2=C(C=C(C=C2)[N+](=O)[O-])C#N)O

InChI

InChI=1S/C15H13N3O3/c16-9-12-8-13(18(20)21)6-7-14(12)17-10-15(19)11-4-2-1-3-5-11/h1-8,15,17,19H,10H2