2-(4-bromanyl-2,5-dimethoxy-phenyl)-N-[(4-nitrophenyl)methyl]ethanamine

Systemtic Name: 2-(4-bromanyl-2,5-dimethoxy-phenyl)-N-[(4-nitrophenyl)methyl]ethanamine Openeye Name: 2-(4-bromo-2,5-dimethoxy-phenyl)-N-[(4-nitrophenyl)methyl]ethanamine CAS Name: 2-(4-bromo-2,5-dimethoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine IUPAC Name: 2-(4-bromo-2,5-dimethoxyphenyl)-N-[(4-nitrophenyl)methyl]ethanamine Traditional Name: 2-(4-bromo-2,5-dimethoxy-phenyl)ethyl-(4-nitrobenzyl)amine Formula: C17H19BrN2O4 MolecularWeight: 395.24776

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1CCNCC2=CC=C(C=C2)[N+](=O)[O-])OC)Br

Isomeric SMILES

COC1=CC(=C(C=C1CCNCC2=CC=C(C=C2)[N+](=O)[O-])OC)Br

InChI

InChI=1S/C17H19BrN2O4/c1-23-16-10-15(18)17(24-2)9-13(16)7-8-19-11-12-3-5-14(6-4-12)20(21)22/h3-6,9-10,19H,7-8,11H2,1-2H3