N-heptan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline

Systemtic Name: N-heptan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline Openeye Name: N-(1-methylhexyl)-4-(1,2,4-triazol-1-ylmethyl)aniline CAS Name: N-heptan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline IUPAC Name: N-heptan-2-yl-4-(1,2,4-triazol-1-ylmethyl)aniline Traditional Name: 1-methylhexyl-[4-(1,2,4-triazol-1-ylmethyl)phenyl]amine Formula: C16H24N4 MolecularWeight: 272.38856

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=CC=C(C=C1)CN2C=NC=N2

Isomeric SMILES

CCCCCC(C)NC1=CC=C(C=C1)CN2C=NC=N2

InChI

InChI=1S/C16H24N4/c1-3-4-5-6-14(2)19-16-9-7-15(8-10-16)11-20-13-17-12-18-20/h7-10,12-14,19H,3-6,11H2,1-2H3