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

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

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)C=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

Isomeric SMILES

CN1C(=NC(=N1)C=O)NCCCOC2=CC=CC(=C2)CN3CCCCC3

InChI

InChI=1S/C19H27N5O2/c1-23-19(21-18(15-25)22-23)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,20,21,22)