N-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]-3-nitro-aniline

Systemtic Name: N-[[3,5-bis(bromanyl)-2-methoxy-phenyl]methyl]-3-nitro-aniline Openeye Name: N-[(3,5-dibromo-2-methoxy-phenyl)methyl]-3-nitro-aniline CAS Name: N-[(3,5-dibromo-2-methoxyphenyl)methyl]-3-nitroaniline IUPAC Name: N-[(3,5-dibromo-2-methoxyphenyl)methyl]-3-nitroaniline Traditional Name: (3,5-dibromo-2-methoxy-benzyl)-(3-nitrophenyl)amine Formula: C14H12Br2N2O3 MolecularWeight: 416.06468

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1CNC2=CC(=CC=C2)[N+](=O)[O-])Br)Br

Isomeric SMILES

COC1=C(C=C(C=C1CNC2=CC(=CC=C2)[N+](=O)[O-])Br)Br

InChI

InChI=1S/C14H12Br2N2O3/c1-21-14-9(5-10(15)6-13(14)16)8-17-11-3-2-4-12(7-11)18(19)20/h2-7,17H,8H2,1H3