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

Systemtic Name: 4-chloranyl-3-[2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitro-aniline Openeye Name: 4-chloro-3-[2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitro-aniline CAS Name: 4-chloro-3-[2-(1-imidazolylmethyl)phenoxy]-N-methyl-2-nitroaniline IUPAC Name: 4-chloro-3-[2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitroaniline Traditional Name: [4-chloro-3-[2-(imidazol-1-ylmethyl)phenoxy]-2-nitro-phenyl]-methyl-amine Formula: C17H15ClN4O3 MolecularWeight: 358.779

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=C(C=C1)Cl)OC2=CC=CC=C2CN3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C(=C(C=C1)Cl)OC2=CC=CC=C2CN3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15ClN4O3/c1-19-14-7-6-13(18)17(16(14)22(23)24)25-15-5-3-2-4-12(15)10-21-9-8-20-11-21/h2-9,11,19H,10H2,1H3