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

Systemtic Name: 3-chloranyl-N-octyl-2-(1,2,4-triazol-1-yl)aniline Openeye Name: 3-chloro-N-octyl-2-(1,2,4-triazol-1-yl)aniline CAS Name: 3-chloro-N-octyl-2-(1,2,4-triazol-1-yl)aniline IUPAC Name: 3-chloro-N-octyl-2-(1,2,4-triazol-1-yl)aniline Traditional Name: [3-chloro-2-(1,2,4-triazol-1-yl)phenyl]-octyl-amine Formula: C16H23ClN4 MolecularWeight: 306.83362

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC1=C(C(=CC=C1)Cl)N2C=NC=N2

Isomeric SMILES

CCCCCCCCNC1=C(C(=CC=C1)Cl)N2C=NC=N2

InChI

InChI=1S/C16H23ClN4/c1-2-3-4-5-6-7-11-19-15-10-8-9-14(17)16(15)21-13-18-12-20-21/h8-10,12-13,19H,2-7,11H2,1H3