3-[5-butyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[5-butyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-butyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[5-butyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[5-butyl-4-[(4-nitrophenyl)methyl]-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-butyl-4-(4-nitrobenzyl)-1,2,4-triazol-3-yl]pyridine Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NN=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

Isomeric SMILES

CCCCC1=NN=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C3=CN=CC=C3

InChI

InChI=1S/C18H19N5O2/c1-2-3-6-17-20-21-18(15-5-4-11-19-12-15)22(17)13-14-7-9-16(10-8-14)23(24)25/h4-5,7-12H,2-3,6,13H2,1H3