[1-[3-(hydroxymethyl)phenyl]-5-phenyl-1,2,4-triazol-3-yl] hydrogen carbonate

Systemtic Name: [1-[3-(hydroxymethyl)phenyl]-5-phenyl-1,2,4-triazol-3-yl] hydrogen carbonate Openeye Name: [1-[3-(hydroxymethyl)phenyl]-5-phenyl-1,2,4-triazol-3-yl] hydrogen carbonate CAS Name: carbonic acid [1-[3-(hydroxymethyl)phenyl]-5-phenyl-1,2,4-triazol-3-yl] ester IUPAC Name: [1-[3-(hydroxymethyl)phenyl]-5-phenyl-1,2,4-triazol-3-yl] hydrogen carbonate Traditional Name: carbonic acid [1-(3-methylolphenyl)-5-phenyl-1,2,4-triazol-3-yl] ester Formula: C16H13N3O4 MolecularWeight: 311.29212

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC(=C3)CO)OC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=NN2C3=CC=CC(=C3)CO)OC(=O)O

InChI

InChI=1S/C16H13N3O4/c20-10-11-5-4-8-13(9-11)19-14(12-6-2-1-3-7-12)17-15(18-19)23-16(21)22/h1-9,20H,10H2,(H,21,22)