N-[[4-(4-ethyl-3-prop-2-enoxy-phenoxy)phenyl]methyl]-2-methyl-3-nitro-aniline

Systemtic Name: N-[[4-(4-ethyl-3-prop-2-enoxy-phenoxy)phenyl]methyl]-2-methyl-3-nitro-aniline Openeye Name: N-[[4-(3-allyloxy-4-ethyl-phenoxy)phenyl]methyl]-2-methyl-3-nitro-aniline CAS Name: N-[[4-(4-ethyl-3-prop-2-enoxyphenoxy)phenyl]methyl]-2-methyl-3-nitroaniline IUPAC Name: N-[[4-(4-ethyl-3-prop-2-enoxyphenoxy)phenyl]methyl]-2-methyl-3-nitroaniline Traditional Name: [4-(3-allyloxy-4-ethyl-phenoxy)benzyl]-(2-methyl-3-nitro-phenyl)amine Formula: C25H26N2O4 MolecularWeight: 418.48494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)OC2=CC=C(C=C2)CNC3=C(C(=CC=C3)[N+](=O)[O-])C)OCC=C

Isomeric SMILES

CCC1=C(C=C(C=C1)OC2=CC=C(C=C2)CNC3=C(C(=CC=C3)[N+](=O)[O-])C)OCC=C

InChI

InChI=1S/C25H26N2O4/c1-4-15-30-25-16-22(14-11-20(25)5-2)31-21-12-9-19(10-13-21)17-26-23-7-6-8-24(18(23)3)27(28)29/h4,6-14,16,26H,1,5,15,17H2,2-3H3