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

Systemtic Name: 1-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Openeye Name: 1-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine CAS Name: 1-[3-[3-(1-azocanylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine IUPAC Name: 1-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1,2,4-triazole-3,5-diamine Traditional Name: [5-amino-1-[3-[3-(azocan-1-ylmethyl)phenoxy]propyl]-1,2,4-triazol-3-yl]amine Formula: C19H30N6O MolecularWeight: 358.4811

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)CC2=CC(=CC=C2)OCCCN3C(=NC(=N3)N)N

Isomeric SMILES

C1CCCN(CCC1)CC2=CC(=CC=C2)OCCCN3C(=NC(=N3)N)N

InChI

InChI=1S/C19H30N6O/c20-18-22-19(21)25(23-18)12-7-13-26-17-9-6-8-16(14-17)15-24-10-4-2-1-3-5-11-24/h6,8-9,14H,1-5,7,10-13,15H2,(H4,20,21,22,23)