1-[1-(2-methylphenyl)ethylamino]-3-(3-nitrophenoxy)propan-2-ol

Systemtic Name: 1-[1-(2-methylphenyl)ethylamino]-3-(3-nitrophenoxy)propan-2-ol Openeye Name: 1-(3-nitrophenoxy)-3-[1-(o-tolyl)ethylamino]propan-2-ol CAS Name: 1-[1-(2-methylphenyl)ethylamino]-3-(3-nitrophenoxy)-2-propanol IUPAC Name: 1-[1-(2-methylphenyl)ethylamino]-3-(3-nitrophenoxy)propan-2-ol Traditional Name: 1-(3-nitrophenoxy)-3-[1-(o-tolyl)ethylamino]propan-2-ol Formula: C18H22N2O4 MolecularWeight: 330.37828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(C)NCC(COC2=CC=CC(=C2)[N+](=O)[O-])O

Isomeric SMILES

CC1=CC=CC=C1C(C)NCC(COC2=CC=CC(=C2)[N+](=O)[O-])O

InChI

InChI=1S/C18H22N2O4/c1-13-6-3-4-9-18(13)14(2)19-11-16(21)12-24-17-8-5-7-15(10-17)20(22)23/h3-10,14,16,19,21H,11-12H2,1-2H3