N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide

Systemtic Name: N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Openeye Name: N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide CAS Name: N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-1-piperazinecarboxamide IUPAC Name: N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Traditional Name: N,N-dimethyl-4-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperazine-1-carboxamide Formula: C16H21N7O3 MolecularWeight: 359.38304

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)N1CCN(CC1)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CN(C)C(=O)N1CCN(CC1)CN2C=NC(=N2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N7O3/c1-19(2)16(24)21-9-7-20(8-10-21)12-22-11-17-15(18-22)13-3-5-14(6-4-13)23(25)26/h3-6,11H,7-10,12H2,1-2H3