N'-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-N'-(phenylmethyl)ethane-1,2-diamine

Systemtic Name: N'-[(4,5-dimethoxy-2-nitro-phenyl)methyl]-N'-(phenylmethyl)ethane-1,2-diamine Openeye Name: N'-benzyl-N'-[(4,5-dimethoxy-2-nitro-phenyl)methyl]ethane-1,2-diamine CAS Name: N'-[(4,5-dimethoxy-2-nitrophenyl)methyl]-N'-(phenylmethyl)ethane-1,2-diamine IUPAC Name: N'-benzyl-N'-[(4,5-dimethoxy-2-nitrophenyl)methyl]ethane-1,2-diamine Traditional Name: 2-aminoethyl-benzyl-(4,5-dimethoxy-2-nitro-benzyl)amine Formula: C18H23N3O4 MolecularWeight: 345.39292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)CN(CCN)CC2=CC=CC=C2)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C(=C1)CN(CCN)CC2=CC=CC=C2)[N+](=O)[O-])OC

InChI

InChI=1S/C18H23N3O4/c1-24-17-10-15(16(21(22)23)11-18(17)25-2)13-20(9-8-19)12-14-6-4-3-5-7-14/h3-7,10-11H,8-9,12-13,19H2,1-2H3