(4-ethoxycarbonylphenyl) 4-(1,2,4-triazol-1-yl)benzoate

Systemtic Name: (4-ethoxycarbonylphenyl) 4-(1,2,4-triazol-1-yl)benzoate Openeye Name: (4-ethoxycarbonylphenyl) 4-(1,2,4-triazol-1-yl)benzoate CAS Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-ethoxycarbonylphenyl) ester IUPAC Name: (4-ethoxycarbonylphenyl) 4-(1,2,4-triazol-1-yl)benzoate Traditional Name: 4-(1,2,4-triazol-1-yl)benzoic acid (4-carbethoxyphenyl) ester Formula: C18H15N3O4 MolecularWeight: 337.3294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N3C=NC=N3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)N3C=NC=N3

InChI

InChI=1S/C18H15N3O4/c1-2-24-17(22)13-5-9-16(10-6-13)25-18(23)14-3-7-15(8-4-14)21-12-19-11-20-21/h3-12H,2H2,1H3