quinolin-8-ylmethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate

Systemtic Name: quinolin-8-ylmethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Openeye Name: 8-quinolylmethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate CAS Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid 8-quinolinylmethyl ester IUPAC Name: quinolin-8-ylmethyl 4-(1,2,4-triazol-1-ylmethyl)benzoate Traditional Name: 4-(1,2,4-triazol-1-ylmethyl)benzoic acid 8-quinolylmethyl ester Formula: C20H16N4O2 MolecularWeight: 344.36664

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4)N=CC=C2

Isomeric SMILES

C1=CC2=C(C(=C1)COC(=O)C3=CC=C(C=C3)CN4C=NC=N4)N=CC=C2

InChI

InChI=1S/C20H16N4O2/c25-20(17-8-6-15(7-9-17)11-24-14-21-13-23-24)26-12-18-4-1-3-16-5-2-10-22-19(16)18/h1-10,13-14H,11-12H2