N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide

Systemtic Name: N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide Openeye Name: N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-4-piperidyl]cyclopropanecarboxamide CAS Name: N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-4-piperidinyl]cyclopropanecarboxamide IUPAC Name: N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]piperidin-4-yl]cyclopropanecarboxamide Traditional Name: N-[1-[[3-(4-nitrophenyl)-1,2,4-triazol-1-yl]methyl]-4-piperidyl]cyclopropanecarboxamide Formula: C18H22N6O3 MolecularWeight: 370.40568

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2CCN(CC2)CN3C=NC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)NC2CCN(CC2)CN3C=NC(=N3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H22N6O3/c25-18(14-1-2-14)20-15-7-9-22(10-8-15)12-23-11-19-17(21-23)13-3-5-16(6-4-13)24(26)27/h3-6,11,14-15H,1-2,7-10,12H2,(H,20,25)