2-(2,4-dichlorophenyl)-5-oxidanyl-4-(1,2,4-triazol-1-yl)pentanal

Systemtic Name: 2-(2,4-dichlorophenyl)-5-oxidanyl-4-(1,2,4-triazol-1-yl)pentanal Openeye Name: 2-(2,4-dichlorophenyl)-5-hydroxy-4-(1,2,4-triazol-1-yl)pentanal CAS Name: 2-(2,4-dichlorophenyl)-5-hydroxy-4-(1,2,4-triazol-1-yl)pentanal IUPAC Name: 2-(2,4-dichlorophenyl)-5-hydroxy-4-(1,2,4-triazol-1-yl)pentanal Traditional Name: 2-(2,4-dichlorophenyl)-5-hydroxy-4-(1,2,4-triazol-1-yl)valeraldehyde Formula: C13H13Cl2N3O2 MolecularWeight: 314.16722

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(CC(CO)N2C=NC=N2)C=O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(CC(CO)N2C=NC=N2)C=O

InChI

InChI=1S/C13H13Cl2N3O2/c14-10-1-2-12(13(15)4-10)9(5-19)3-11(6-20)18-8-16-7-17-18/h1-2,4-5,7-9,11,20H,3,6H2