3-butoxy-N-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzenecarboximidate

Systemtic Name: 3-butoxy-N-[3-(2H-1,2,3,4-tetrazol-5-yl)phenyl]benzenecarboximidate Openeye Name: 3-butoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate CAS Name: 3-butoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate IUPAC Name: 3-butoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate Traditional Name: 3-butoxy-N-[3-(2H-tetrazol-5-yl)phenyl]benzenecarboximidate Formula: C18H18N5O2- MolecularWeight: 336.36782

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=NC2=CC=CC(=C2)C3=NNN=N3)[O-]

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=NC2=CC=CC(=C2)C3=NNN=N3)[O-]

InChI

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