3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol

Systemtic Name: 3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol Openeye Name: 3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol CAS Name: 3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol IUPAC Name: 3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol Traditional Name: 3,5-dimethoxy-2-[[2-(4-nitrophenyl)ethylamino]methyl]phenol Formula: C17H20N2O5 MolecularWeight: 332.3511

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C(=C1)OC)CNCCC2=CC=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

COC1=CC(=C(C(=C1)OC)CNCCC2=CC=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C17H20N2O5/c1-23-14-9-16(20)15(17(10-14)24-2)11-18-8-7-12-3-5-13(6-4-12)19(21)22/h3-6,9-10,18,20H,7-8,11H2,1-2H3