5-chloranyl-N-methyl-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]aniline

Systemtic Name: 5-chloranyl-N-methyl-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]aniline Openeye Name: 5-chloro-N-methyl-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]aniline CAS Name: 5-chloro-N-methyl-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]aniline IUPAC Name: 5-chloro-N-methyl-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]aniline Traditional Name: [5-chloro-2-nitro-3-[2-(1,2,4-triazol-1-ylmethyl)phenoxy]phenyl]-methyl-amine Formula: C16H14ClN5O3 MolecularWeight: 359.76706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC1=CC(=CC(=C1[N+](=O)[O-])OC2=CC=CC=C2CN3C=NC=N3)Cl

Isomeric SMILES

CNC1=CC(=CC(=C1[N+](=O)[O-])OC2=CC=CC=C2CN3C=NC=N3)Cl

InChI

InChI=1S/C16H14ClN5O3/c1-18-13-6-12(17)7-15(16(13)22(23)24)25-14-5-3-2-4-11(14)8-21-10-19-9-20-21/h2-7,9-10,18H,8H2,1H3