5-[(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enyl]-1H-1,2,4-triazole

Systemtic Name: 5-[(E)-3-(3-methoxy-4-phenylmethoxy-phenyl)prop-2-enyl]-1H-1,2,4-triazole Openeye Name: 5-[(E)-3-(4-benzyloxy-3-methoxy-phenyl)allyl]-1H-1,2,4-triazole CAS Name: 5-[(E)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enyl]-1H-1,2,4-triazole IUPAC Name: 5-[(E)-3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enyl]-1H-1,2,4-triazole Traditional Name: 5-[(E)-3-(4-benzoxy-3-methoxy-phenyl)allyl]-1H-1,2,4-triazole Formula: C19H19N3O2 MolecularWeight: 321.37306

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CCC2=NC=NN2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/CC2=NC=NN2)OCC3=CC=CC=C3

InChI

InChI=1S/C19H19N3O2/c1-23-18-12-15(8-5-9-19-20-14-21-22-19)10-11-17(18)24-13-16-6-3-2-4-7-16/h2-8,10-12,14H,9,13H2,1H3,(H,20,21,22)/b8-5+