N-(4-methyl-3,5-dinitro-phenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide

Systemtic Name: N-(4-methyl-3,5-dinitro-phenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide Openeye Name: N-(4-methyl-3,5-dinitro-phenyl)-5-(1-piperidylmethyl)furan-2-carboxamide CAS Name: N-(4-methyl-3,5-dinitrophenyl)-5-(1-piperidinylmethyl)-2-furancarboxamide IUPAC Name: N-(4-methyl-3,5-dinitrophenyl)-5-(piperidin-1-ylmethyl)furan-2-carboxamide Traditional Name: N-(4-methyl-3,5-dinitro-phenyl)-5-(piperidinomethyl)-2-furamide Formula: C18H20N4O6 MolecularWeight: 388.3746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3CCCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1[N+](=O)[O-])NC(=O)C2=CC=C(O2)CN3CCCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O6/c1-12-15(21(24)25)9-13(10-16(12)22(26)27)19-18(23)17-6-5-14(28-17)11-20-7-3-2-4-8-20/h5-6,9-10H,2-4,7-8,11H2,1H3,(H,19,23)