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

Systemtic Name: N,N-diethyl-3-[[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]aniline Openeye Name: N,N-diethyl-3-[[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]aniline CAS Name: N,N-diethyl-3-[[3-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazol-5-yl]methoxy]aniline IUPAC Name: N,N-diethyl-3-[[3-(3-methyl-4-nitrophenyl)-1H-1,2,4-triazol-5-yl]methoxy]aniline Traditional Name: diethyl-[3-[[3-(3-methyl-4-nitro-phenyl)-1H-1,2,4-triazol-5-yl]methoxy]phenyl]amine Formula: C20H23N5O3 MolecularWeight: 381.42832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23N5O3/c1-4-24(5-2)16-7-6-8-17(12-16)28-13-19-21-20(23-22-19)15-9-10-18(25(26)27)14(3)11-15/h6-12H,4-5,13H2,1-3H3,(H,21,22,23)