5-nitro-2-(2-quinolin-8-ylethylamino)benzenecarbonitrile

Systemtic Name: 5-nitro-2-(2-quinolin-8-ylethylamino)benzenecarbonitrile Openeye Name: 5-nitro-2-[2-(8-quinolyl)ethylamino]benzonitrile CAS Name: 5-nitro-2-[2-(8-quinolinyl)ethylamino]benzonitrile IUPAC Name: 5-nitro-2-(2-quinolin-8-ylethylamino)benzonitrile Traditional Name: 5-nitro-2-[2-(8-quinolyl)ethylamino]benzonitrile Formula: C18H14N4O2 MolecularWeight: 318.32936

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)CCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)CCNC3=C(C=C(C=C3)[N+](=O)[O-])C#N)N=CC=C2

InChI

InChI=1S/C18H14N4O2/c19-12-15-11-16(22(23)24)6-7-17(15)20-10-8-14-4-1-3-13-5-2-9-21-18(13)14/h1-7,9,11,20H,8,10H2