3-[5-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)-1,2,4-triazol-3-yl]benzaldehyde

Systemtic Name: 3-[5-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)-1,2,4-triazol-3-yl]benzaldehyde Openeye Name: 3-[5-(4-methoxyphenyl)-2-(3-pyridylmethyl)-1,2,4-triazol-3-yl]benzaldehyde CAS Name: 3-[5-(4-methoxyphenyl)-2-(3-pyridinylmethyl)-1,2,4-triazol-3-yl]benzaldehyde IUPAC Name: 3-[5-(4-methoxyphenyl)-2-(pyridin-3-ylmethyl)-1,2,4-triazol-3-yl]benzaldehyde Traditional Name: 3-[5-(4-methoxyphenyl)-2-(3-pyridylmethyl)-1,2,4-triazol-3-yl]benzaldehyde Formula: C22H18N4O2 MolecularWeight: 370.40392

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN(C(=N2)C3=CC(=CC=C3)C=O)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN(C(=N2)C3=CC(=CC=C3)C=O)CC4=CN=CC=C4

InChI

InChI=1S/C22H18N4O2/c1-28-20-9-7-18(8-10-20)21-24-22(19-6-2-4-16(12-19)15-27)26(25-21)14-17-5-3-11-23-13-17/h2-13,15H,14H2,1H3