N-hexan-2-yl-3-(1,2,4-triazol-4-yl)aniline

Systemtic Name: N-hexan-2-yl-3-(1,2,4-triazol-4-yl)aniline Openeye Name: N-(1-methylpentyl)-3-(1,2,4-triazol-4-yl)aniline CAS Name: N-hexan-2-yl-3-(1,2,4-triazol-4-yl)aniline IUPAC Name: N-hexan-2-yl-3-(1,2,4-triazol-4-yl)aniline Traditional Name: 1-methylpentyl-[3-(1,2,4-triazol-4-yl)phenyl]amine Formula: C14H20N4 MolecularWeight: 244.3354

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)NC1=CC=CC(=C1)N2C=NN=C2

Isomeric SMILES

CCCCC(C)NC1=CC=CC(=C1)N2C=NN=C2

InChI

InChI=1S/C14H20N4/c1-3-4-6-12(2)17-13-7-5-8-14(9-13)18-10-15-16-11-18/h5,7-12,17H,3-4,6H2,1-2H3