4-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazole-3-carbaldehyde

Systemtic Name: 4-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazole-3-carbaldehyde Openeye Name: 4-methyl-5-[3-[3-(1-piperidylmethyl)phenoxy]propylamino]-1,2,4-triazole-3-carbaldehyde CAS Name: 4-methyl-5-[3-[3-(1-piperidinylmethyl)phenoxy]propylamino]-1,2,4-triazole-3-carboxaldehyde IUPAC Name: 4-methyl-5-[3-[3-(piperidin-1-ylmethyl)phenoxy]propylamino]-1,2,4-triazole-3-carbaldehyde Traditional Name: 4-methyl-5-[3-[3-(piperidinomethyl)phenoxy]propylamino]-1,2,4-triazole-3-carbaldehyde Formula: C19H27N5O2 MolecularWeight: 357.44998

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1NCCCOC2=CC=CC(=C2)CN3CCCCC3)C=O

Isomeric SMILES

CN1C(=NN=C1NCCCOC2=CC=CC(=C2)CN3CCCCC3)C=O

InChI

InChI=1S/C19H27N5O2/c1-23-18(15-25)21-22-19(23)20-9-6-12-26-17-8-5-7-16(13-17)14-24-10-3-2-4-11-24/h5,7-8,13,15H,2-4,6,9-12,14H2,1H3,(H,20,22)