2-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-1,2,4-triazol-3-amine

Systemtic Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-1,2,4-triazol-3-amine Openeye Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-1,2,4-triazol-3-amine CAS Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-1,2,4-triazol-3-amine IUPAC Name: 2-[3-[3-(dimethylaminomethyl)phenoxy]propyl]-1,2,4-triazol-3-amine Traditional Name: [3-[3-(5-amino-1,2,4-triazol-1-yl)propoxy]benzyl]-dimethyl-amine Formula: C14H21N5O MolecularWeight: 275.34944

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC1=CC(=CC=C1)OCCCN2C(=NC=N2)N

Isomeric SMILES

CN(C)CC1=CC(=CC=C1)OCCCN2C(=NC=N2)N

InChI

InChI=1S/C14H21N5O/c1-18(2)10-12-5-3-6-13(9-12)20-8-4-7-19-14(15)16-11-17-19/h3,5-6,9,11H,4,7-8,10H2,1-2H3,(H2,15,16,17)