2-methoxy-4-[3-[4-(2-methylpropoxy)-3-nitro-phenyl]-1H-1,2,4-triazol-5-yl]pyridine

Systemtic Name: 2-methoxy-4-[3-[4-(2-methylpropoxy)-3-nitro-phenyl]-1H-1,2,4-triazol-5-yl]pyridine Openeye Name: 4-[3-(4-isobutoxy-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]-2-methoxy-pyridine CAS Name: 2-methoxy-4-[3-[4-(2-methylpropoxy)-3-nitrophenyl]-1H-1,2,4-triazol-5-yl]pyridine IUPAC Name: 2-methoxy-4-[3-[4-(2-methylpropoxy)-3-nitrophenyl]-1H-1,2,4-triazol-5-yl]pyridine Traditional Name: 4-[3-(4-isobutoxy-3-nitro-phenyl)-1H-1,2,4-triazol-5-yl]-2-methoxy-pyridine Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC(=NC=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C)COC1=C(C=C(C=C1)C2=NNC(=N2)C3=CC(=NC=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O4/c1-11(2)10-27-15-5-4-12(8-14(15)23(24)25)17-20-18(22-21-17)13-6-7-19-16(9-13)26-3/h4-9,11H,10H2,1-3H3,(H,20,21,22)