(2E)-2-(5-nitro-10-oxidanylidene-phenanthren-9-ylidene)-2-phenyl-ethanenitrile

Systemtic Name: (2E)-2-(5-nitro-10-oxidanylidene-phenanthren-9-ylidene)-2-phenyl-ethanenitrile Openeye Name: (2E)-2-(5-nitro-10-oxo-9-phenanthrylidene)-2-phenyl-acetonitrile CAS Name: (2E)-2-(5-nitro-10-oxo-9-phenanthrenylidene)-2-phenylacetonitrile IUPAC Name: (2E)-2-(5-nitro-10-oxophenanthren-9-ylidene)-2-phenylacetonitrile Traditional Name: (2E)-2-(10-keto-5-nitro-9-phenanthrylidene)-2-phenyl-acetonitrile Formula: C22H12N2O3 MolecularWeight: 352.34228

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=C2C3=C(C4=CC=CC=C4C2=O)C(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\2/C3=C(C4=CC=CC=C4C2=O)C(=CC=C3)[N+](=O)[O-])/C#N

InChI

InChI=1S/C22H12N2O3/c23-13-18(14-7-2-1-3-8-14)21-17-11-6-12-19(24(26)27)20(17)15-9-4-5-10-16(15)22(21)25/h1-12H/b21-18-