(3-phenyl-1,2,4-oxadiazol-5-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (3S)-6-chlorochromane-3-carboxylate CAS Name: (3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-phenyl-1,2,4-oxadiazol-5-yl)methyl (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (3S)-6-chlorochroman-3-carboxylic acid (3-phenyl-1,2,4-oxadiazol-5-yl)methyl ester Formula: C19H15ClN2O4 MolecularWeight: 370.7864

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Descriptors Computed from Structure

Canonical SMILES:

C1C(COC2=C1C=C(C=C2)Cl)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

C1[C@@H](COC2=C1C=C(C=C2)Cl)C(=O)OCC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C19H15ClN2O4/c20-15-6-7-16-13(9-15)8-14(10-24-16)19(23)25-11-17-21-18(22-26-17)12-4-2-1-3-5-12/h1-7,9,14H,8,10-11H2/t14-/m0/s1