3-[[3-(4-chloranyl-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]-N,N-diethyl-aniline

Systemtic Name: 3-[[3-(4-chloranyl-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]-N,N-diethyl-aniline Openeye Name: 3-[[3-(4-chloro-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]-N,N-diethyl-aniline CAS Name: 3-[[3-(4-chloro-3-nitrophenyl)-1H-1,2,4-triazol-5-yl]methoxy]-N,N-diethylaniline IUPAC Name: 3-[[3-(4-chloro-3-nitrophenyl)-1H-1,2,4-triazol-5-yl]methoxy]-N,N-diethylaniline Traditional Name: [3-[[3-(4-chloro-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]phenyl]-diethyl-amine Formula: C19H20ClN5O3 MolecularWeight: 401.8468

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC(=CC=C1)OCC2=NC(=NN2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C1=CC(=CC=C1)OCC2=NC(=NN2)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN5O3/c1-3-24(4-2)14-6-5-7-15(11-14)28-12-18-21-19(23-22-18)13-8-9-16(20)17(10-13)25(26)27/h5-11H,3-4,12H2,1-2H3,(H,21,22,23)