N-[1-[3-(3-nitrophenyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide

Systemtic Name: N-[1-[3-(3-nitrophenyl)-5-oxidanylidene-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide Openeye Name: N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide CAS Name: N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide IUPAC Name: N-[1-[3-(3-nitrophenyl)-5-oxo-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide Traditional Name: N-[1-[5-keto-3-(3-nitrophenyl)-2H-1,2,4-triazin-6-yl]propyl]cyclopentanecarboxamide Formula: C18H21N5O4 MolecularWeight: 371.39044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCCC3

Isomeric SMILES

CCC(C1=NNC(=NC1=O)C2=CC(=CC=C2)[N+](=O)[O-])NC(=O)C3CCCC3

InChI

InChI=1S/C18H21N5O4/c1-2-14(19-17(24)11-6-3-4-7-11)15-18(25)20-16(22-21-15)12-8-5-9-13(10-12)23(26)27/h5,8-11,14H,2-4,6-7H2,1H3,(H,19,24)(H,20,22,25)