1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine

Systemtic Name: 1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-[3-[3-(aminomethyl)phenoxy]propyl]-1,2,4-triazol-3-yl]amine Formula: C12H18N6O MolecularWeight: 262.31092

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCCN2C(=NC(=N2)N)N)CN

Isomeric SMILES

C1=CC(=CC(=C1)OCCCN2C(=NC(=N2)N)N)CN

InChI

InChI=1S/C12H18N6O/c13-8-9-3-1-4-10(7-9)19-6-2-5-18-12(15)16-11(14)17-18/h1,3-4,7H,2,5-6,8,13H2,(H4,14,15,16,17)