N'-[(4-methoxy-3-nitro-phenyl)methyl]-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine

Systemtic Name: N'-[(4-methoxy-3-nitro-phenyl)methyl]-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine Openeye Name: N'-[(4-methoxy-3-nitro-phenyl)methyl]-N'-(4-pyridylmethyl)ethane-1,2-diamine CAS Name: N'-[(4-methoxy-3-nitrophenyl)methyl]-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine IUPAC Name: N'-[(4-methoxy-3-nitrophenyl)methyl]-N'-(pyridin-4-ylmethyl)ethane-1,2-diamine Traditional Name: 2-aminoethyl-(4-methoxy-3-nitro-benzyl)-(4-pyridylmethyl)amine Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H20N4O3/c1-23-16-3-2-14(10-15(16)20(21)22)12-19(9-6-17)11-13-4-7-18-8-5-13/h2-5,7-8,10H,6,9,11-12,17H2,1H3