methyl (2S)-6-methyl-4-oxidanyl-3'-oxidanylidene-spiro[3H-1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate

Systemtic Name: methyl (2S)-6-methyl-4-oxidanyl-3'-oxidanylidene-spiro[3H-1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate Openeye Name: methyl (2S)-4-hydroxy-6-methyl-3'-oxo-spiro[3H-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate CAS Name: (2S)-4-hydroxy-6-methyl-3'-oxo-1'-spiro[3H-benzofuran-2,6'-cyclohexa-1,4-diene]carboxylic acid methyl ester IUPAC Name: methyl (2S)-4-hydroxy-6-methyl-3'-oxospiro[3H-1-benzofuran-2,6'-cyclohexa-1,4-diene]-1'-carboxylate Traditional Name: (2S)-4-hydroxy-3'-keto-6-methyl-spiro[coumaran-2,6'-cyclohexa-1,4-diene]-1'-carboxylic acid methyl ester Formula: C16H14O5 MolecularWeight: 286.27936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC3(O2)C=CC(=O)C=C3C(=O)OC)C(=C1)O

Isomeric SMILES

CC1=CC2=C(C[C@]3(O2)C=CC(=O)C=C3C(=O)OC)C(=C1)O

InChI

InChI=1S/C16H14O5/c1-9-5-13(18)11-8-16(21-14(11)6-9)4-3-10(17)7-12(16)15(19)20-2/h3-7,18H,8H2,1-2H3/t16-/m1/s1