(5-fluoranyl-2-methoxy-phenyl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate

Systemtic Name: (5-fluoranyl-2-methoxy-phenyl)methyl (3S)-6-chloranyl-3,4-dihydro-2H-chromene-3-carboxylate Openeye Name: (5-fluoro-2-methoxy-phenyl)methyl (3S)-6-chlorochromane-3-carboxylate CAS Name: (3S)-6-chloro-3,4-dihydro-2H-1-benzopyran-3-carboxylic acid (5-fluoro-2-methoxyphenyl)methyl ester IUPAC Name: (5-fluoro-2-methoxyphenyl)methyl (3S)-6-chloro-3,4-dihydro-2H-chromene-3-carboxylate Traditional Name: (3S)-6-chlorochroman-3-carboxylic acid (5-fluoro-2-methoxy-benzyl) ester Formula: C18H16ClFO4 MolecularWeight: 350.768643

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)F)COC(=O)C2CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

COC1=C(C=C(C=C1)F)COC(=O)[C@H]2CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C18H16ClFO4/c1-22-16-5-3-15(20)8-12(16)9-24-18(21)13-6-11-7-14(19)2-4-17(11)23-10-13/h2-5,7-8,13H,6,9-10H2,1H3/t13-/m0/s1