methyl (2S)-8-chloranyl-4-oxidanylidene-2-(phenylmethyl)-2,3-dihydrochromene-6-carboxylate

Systemtic Name: methyl (2S)-8-chloranyl-4-oxidanylidene-2-(phenylmethyl)-2,3-dihydrochromene-6-carboxylate Openeye Name: methyl (2S)-2-benzyl-8-chloro-4-oxo-chromane-6-carboxylate CAS Name: (2S)-8-chloro-4-oxo-2-(phenylmethyl)-3,4-dihydro-2H-1-benzopyran-6-carboxylic acid methyl ester IUPAC Name: methyl (2S)-2-benzyl-8-chloro-4-oxo-2,3-dihydrochromene-6-carboxylate Traditional Name: (2S)-2-benzyl-8-chloro-4-keto-chroman-6-carboxylic acid methyl ester Formula: C18H15ClO4 MolecularWeight: 330.7623

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C2C(=C1)C(=O)CC(O2)CC3=CC=CC=C3)Cl

Isomeric SMILES

COC(=O)C1=CC(=C2C(=C1)C(=O)C[C@@H](O2)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C18H15ClO4/c1-22-18(21)12-8-14-16(20)10-13(23-17(14)15(19)9-12)7-11-5-3-2-4-6-11/h2-6,8-9,13H,7,10H2,1H3/t13-/m0/s1