5-[(5,6-dimethylbenzotriazol-1-yl)methyl]furan-2-carboxylate

Systemtic Name: 5-[(5,6-dimethylbenzotriazol-1-yl)methyl]furan-2-carboxylate Openeye Name: 5-[(5,6-dimethylbenzotriazol-1-yl)methyl]furan-2-carboxylate CAS Name: 5-[(5,6-dimethyl-1-benzotriazolyl)methyl]-2-furancarboxylate IUPAC Name: 5-[(5,6-dimethylbenzotriazol-1-yl)methyl]furan-2-carboxylate Traditional Name: 5-[(5,6-dimethylbenzotriazol-1-yl)methyl]-2-furoate Formula: C14H12N3O3- MolecularWeight: 270.26338

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N(N=N2)CC3=CC=C(O3)C(=O)[O-]

Isomeric SMILES

CC1=CC2=C(C=C1C)N(N=N2)CC3=CC=C(O3)C(=O)[O-]

InChI

InChI=1S/C14H13N3O3/c1-8-5-11-12(6-9(8)2)17(16-15-11)7-10-3-4-13(20-10)14(18)19/h3-6H,7H2,1-2H3,(H,18,19)/p-1