[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 6-chloranyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl 6-chloro-4-oxo-chromene-2-carboxylate CAS Name: 6-chloro-4-oxo-1-benzopyran-2-carboxylic acid [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl ester IUPAC Name: [5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl 6-chloro-4-oxochromene-2-carboxylate Traditional Name: 6-chloro-4-keto-chromene-2-carboxylic acid [5-(m-tolyl)-1,3,4-oxadiazol-2-yl]methyl ester Formula: C20H13ClN2O5 MolecularWeight: 396.78062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NN=C(O2)COC(=O)C3=CC(=O)C4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C20H13ClN2O5/c1-11-3-2-4-12(7-11)19-23-22-18(28-19)10-26-20(25)17-9-15(24)14-8-13(21)5-6-16(14)27-17/h2-9H,10H2,1H3