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

Systemtic Name: 5-[4-chloranyl-2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitro-aniline Openeye Name: 5-[4-chloro-2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitro-aniline CAS Name: 5-[4-chloro-2-(1-imidazolylmethyl)phenoxy]-N-methyl-2-nitroaniline IUPAC Name: 5-[4-chloro-2-(imidazol-1-ylmethyl)phenoxy]-N-methyl-2-nitroaniline Traditional Name: [5-[4-chloro-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=CC(=C1)OC2=C(C=C(C=C2)Cl)CN3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=CC(=C1)OC2=C(C=C(C=C2)Cl)CN3C=CN=C3)[N+](=O)[O-]

InChI

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