N-[3-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]cyclooctanamine

Systemtic Name: N-[3-chloranyl-2-(1,2,4-triazol-1-yl)phenyl]cyclooctanamine Openeye Name: N-[3-chloro-2-(1,2,4-triazol-1-yl)phenyl]cyclooctanamine CAS Name: N-[3-chloro-2-(1,2,4-triazol-1-yl)phenyl]cyclooctanamine IUPAC Name: N-[3-chloro-2-(1,2,4-triazol-1-yl)phenyl]cyclooctanamine Traditional Name: [3-chloro-2-(1,2,4-triazol-1-yl)phenyl]-cyclooctyl-amine Formula: C16H21ClN4 MolecularWeight: 304.81774

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CCC1)NC2=C(C(=CC=C2)Cl)N3C=NC=N3

Isomeric SMILES

C1CCCC(CCC1)NC2=C(C(=CC=C2)Cl)N3C=NC=N3

InChI

InChI=1S/C16H21ClN4/c17-14-9-6-10-15(16(14)21-12-18-11-19-21)20-13-7-4-2-1-3-5-8-13/h6,9-13,20H,1-5,7-8H2