(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl anthracene-9-carboxylate

Systemtic Name: (1-phenyl-1,2,3,4-tetrazol-5-yl)methyl anthracene-9-carboxylate Openeye Name: (1-phenyltetrazol-5-yl)methyl anthracene-9-carboxylate CAS Name: 9-anthracenecarboxylic acid (1-phenyl-5-tetrazolyl)methyl ester IUPAC Name: (1-phenyltetrazol-5-yl)methyl anthracene-9-carboxylate Traditional Name: anthracene-9-carboxylic acid (1-phenyltetrazol-5-yl)methyl ester Formula: C23H16N4O2 MolecularWeight: 380.39874

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

Isomeric SMILES

C1=CC=C(C=C1)N2C(=NN=N2)COC(=O)C3=C4C=CC=CC4=CC5=CC=CC=C53

InChI

InChI=1S/C23H16N4O2/c28-23(29-15-21-24-25-26-27(21)18-10-2-1-3-11-18)22-19-12-6-4-8-16(19)14-17-9-5-7-13-20(17)22/h1-14H,15H2