(4-chloranyl-3-nitro-phenyl)-[5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone

Systemtic Name: (4-chloranyl-3-nitro-phenyl)-[5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone Openeye Name: (4-chloro-3-nitro-phenyl)-[5-(2-furylmethylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]methanone CAS Name: (4-chloro-3-nitrophenyl)-[5-(2-furanylmethylamino)-3-(3-pyridinyl)-1,2,4-triazol-1-yl]methanone IUPAC Name: (4-chloro-3-nitrophenyl)-[5-(furan-2-ylmethylamino)-3-pyridin-3-yl-1,2,4-triazol-1-yl]methanone Traditional Name: (4-chloro-3-nitro-phenyl)-[5-(2-furfurylamino)-3-(3-pyridyl)-1,2,4-triazol-1-yl]methanone Formula: C19H13ClN6O4 MolecularWeight: 424.79732

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CN=C1)C2=NN(C(=N2)NCC3=CC=CO3)C(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H13ClN6O4/c20-15-6-5-12(9-16(15)26(28)29)18(27)25-19(22-11-14-4-2-8-30-14)23-17(24-25)13-3-1-7-21-10-13/h1-10H,11H2,(H,22,23,24)