3-nitro-4-[(4-pyrazin-2-yloxyphenyl)amino]benzenecarbonitrile

Systemtic Name: 3-nitro-4-[(4-pyrazin-2-yloxyphenyl)amino]benzenecarbonitrile Openeye Name: 3-nitro-4-(4-pyrazin-2-yloxyanilino)benzonitrile CAS Name: 3-nitro-4-[4-(2-pyrazinyloxy)anilino]benzonitrile IUPAC Name: 3-nitro-4-(4-pyrazin-2-yloxyanilino)benzonitrile Traditional Name: 3-nitro-4-(4-pyrazin-2-yloxyanilino)benzonitrile Formula: C17H11N5O3 MolecularWeight: 333.30094

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])OC3=NC=CN=C3

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C=C2)C#N)[N+](=O)[O-])OC3=NC=CN=C3

InChI

InChI=1S/C17H11N5O3/c18-10-12-1-6-15(16(9-12)22(23)24)21-13-2-4-14(5-3-13)25-17-11-19-7-8-20-17/h1-9,11,21H