4-[1-[(2-chloranyl-5-nitro-phenyl)amino]ethyl]benzenecarbonitrile

Systemtic Name: 4-[1-[(2-chloranyl-5-nitro-phenyl)amino]ethyl]benzenecarbonitrile Openeye Name: 4-[1-(2-chloro-5-nitro-anilino)ethyl]benzonitrile CAS Name: 4-[1-(2-chloro-5-nitroanilino)ethyl]benzonitrile IUPAC Name: 4-[1-(2-chloro-5-nitroanilino)ethyl]benzonitrile Traditional Name: 4-[1-(2-chloro-5-nitro-anilino)ethyl]benzonitrile Formula: C15H12ClN3O2 MolecularWeight: 301.72768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C#N)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC(C1=CC=C(C=C1)C#N)NC2=C(C=CC(=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H12ClN3O2/c1-10(12-4-2-11(9-17)3-5-12)18-15-8-13(19(20)21)6-7-14(15)16/h2-8,10,18H,1H3