2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(5-bromanyl-2-methoxy-phenyl)methyl-methyl-amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-[(5-bromo-2-methoxy-phenyl)methyl-methyl-amino]-5-nitro-benzonitrile CAS Name: 2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-5-nitrobenzonitrile IUPAC Name: 2-[(5-bromo-2-methoxyphenyl)methyl-methylamino]-5-nitrobenzonitrile Traditional Name: 2-[(5-bromo-2-methoxy-benzyl)-methyl-amino]-5-nitro-benzonitrile Formula: C16H14BrN3O3 MolecularWeight: 376.20466

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=CC(=C1)Br)OC)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

Isomeric SMILES

CN(CC1=C(C=CC(=C1)Br)OC)C2=C(C=C(C=C2)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H14BrN3O3/c1-19(10-12-7-13(17)3-6-16(12)23-2)15-5-4-14(20(21)22)8-11(15)9-18/h3-8H,10H2,1-2H3