[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidanylnaphthalene-2-carboxylate

Systemtic Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 1-oxidanylnaphthalene-2-carboxylate Openeye Name: [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl 1-hydroxynaphthalene-2-carboxylate CAS Name: 1-hydroxy-2-naphthalenecarboxylic acid [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 1-hydroxynaphthalene-2-carboxylate Traditional Name: 1-hydroxynaphthalene-2-carboxylic acid [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C21H16N2O4 MolecularWeight: 360.36274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=C(C4=CC=CC=C4C=C3)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=C(C4=CC=CC=C4C=C3)O

InChI

InChI=1S/C21H16N2O4/c1-13-5-4-7-15(11-13)20-23-22-18(27-20)12-26-21(25)17-10-9-14-6-2-3-8-16(14)19(17)24/h2-11,24H,12H2,1H3