1-(4-chloranyl-3-methyl-phenyl)-5-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,4-triazole

Systemtic Name: 1-(4-chloranyl-3-methyl-phenyl)-5-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,4-triazole Openeye Name: 5-(4-benzyloxy-3-methoxy-phenyl)-1-(4-chloro-3-methyl-phenyl)-1,2,4-triazole CAS Name: 1-(4-chloro-3-methylphenyl)-5-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-triazole IUPAC Name: 1-(4-chloro-3-methylphenyl)-5-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-triazole Traditional Name: 5-(4-benzoxy-3-methoxy-phenyl)-1-(4-chloro-3-methyl-phenyl)-1,2,4-triazole Formula: C23H20ClN3O2 MolecularWeight: 405.8768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2C(=NC=N2)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)N2C(=NC=N2)C3=CC(=C(C=C3)OCC4=CC=CC=C4)OC)Cl

InChI

InChI=1S/C23H20ClN3O2/c1-16-12-19(9-10-20(16)24)27-23(25-15-26-27)18-8-11-21(22(13-18)28-2)29-14-17-6-4-3-5-7-17/h3-13,15H,14H2,1-2H3