(3-methylpiperidin-1-yl)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone

Systemtic Name: (3-methylpiperidin-1-yl)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone Openeye Name: (3-methyl-1-piperidyl)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone CAS Name: (3-methyl-1-piperidinyl)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone IUPAC Name: (3-methylpiperidin-1-yl)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone Traditional Name: (3-methylpiperidino)-[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]methanone Formula: C15H17N5O3 MolecularWeight: 315.32718

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1CCCN(C1)C(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H17N5O3/c1-11-3-2-6-18(8-11)15(21)12-4-5-13(14(7-12)20(22)23)19-10-16-9-17-19/h4-5,7,9-11H,2-3,6,8H2,1H3