[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl chromane-3-carboxylate CAS Name: 3,4-dihydro-2H-1-benzopyran-3-carboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester IUPAC Name: [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl 3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: chroman-3-carboxylic acid [3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H15BrN2O4 MolecularWeight: 415.2374

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=CC=CC=C21)C(=O)OCC3=NC(=NO3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1C(COC2=CC=CC=C21)C(=O)OCC3=NC(=NO3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C19H15BrN2O4/c20-15-6-3-5-13(9-15)18-21-17(26-22-18)11-25-19(23)14-8-12-4-1-2-7-16(12)24-10-14/h1-7,9,14H,8,10-11H2