2-[1-(4-bromophenyl)ethylamino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[1-(4-bromophenyl)ethylamino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[1-(4-bromophenyl)ethylamino]-5-nitro-benzonitrile CAS Name: 2-[1-(4-bromophenyl)ethylamino]-5-nitrobenzonitrile IUPAC Name: 2-[1-(4-bromophenyl)ethylamino]-5-nitrobenzonitrile Traditional Name: 2-[1-(4-bromophenyl)ethylamino]-5-nitro-benzonitrile Formula: C15H12BrN3O2 MolecularWeight: 346.17868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12BrN3O2/c1-10(11-2-4-13(16)5-3-11)18-15-7-6-14(19(20)21)8-12(15)9-17/h2-8,10,18H,1H3