4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzenecarbonitrile

Systemtic Name: 4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzenecarbonitrile Openeye Name: 4-[(2-bromophenyl)methyl-methyl-amino]-3-nitro-benzonitrile CAS Name: 4-[(2-bromophenyl)methyl-methylamino]-3-nitrobenzonitrile IUPAC Name: 4-[(2-bromophenyl)methyl-methylamino]-3-nitrobenzonitrile Traditional Name: 4-[(2-bromobenzyl)-methyl-amino]-3-nitro-benzonitrile Formula: C15H12BrN3O2 MolecularWeight: 346.17868

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1Br)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=CC=C1Br)C2=C(C=C(C=C2)C#N)[N+](=O)[O-]

InChI

InChI=1S/C15H12BrN3O2/c1-18(10-12-4-2-3-5-13(12)16)14-7-6-11(9-17)8-15(14)19(20)21/h2-8H,10H2,1H3