4-(3-chloranylpropyl)-1-(phenylmethyl)-1,2,3-triazole

Systemtic Name: 4-(3-chloranylpropyl)-1-(phenylmethyl)-1,2,3-triazole Openeye Name: 1-benzyl-4-(3-chloropropyl)triazole CAS Name: 4-(3-chloropropyl)-1-(phenylmethyl)triazole IUPAC Name: 1-benzyl-4-(3-chloropropyl)triazole Traditional Name: 1-benzyl-4-(3-chloropropyl)triazole Formula: C12H14ClN3 MolecularWeight: 235.71266

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=C(N=N2)CCCCl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=C(N=N2)CCCCl

InChI

InChI=1S/C12H14ClN3/c13-8-4-7-12-10-16(15-14-12)9-11-5-2-1-3-6-11/h1-3,5-6,10H,4,7-9H2