(3-oxidanylidenebenzo[f]chromen-1-yl)methyl (5R,7S)-3-oxidanyladamantane-1-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (5R,7S)-3-oxidanyladamantane-1-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (5R,7S)-3-hydroxyadamantane-1-carboxylate CAS Name: (5R,7S)-3-hydroxy-1-adamantanecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (5R,7S)-3-hydroxyadamantane-1-carboxylate Traditional Name: (5R,7S)-3-hydroxyadamantane-1-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H24O5 MolecularWeight: 404.45506

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)O)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

Isomeric SMILES

C1[C@@H]2CC3(C[C@H]1CC(C2)(C3)O)C(=O)OCC4=CC(=O)OC5=C4C6=CC=CC=C6C=C5

InChI

InChI=1S/C25H24O5/c26-21-8-18(22-19-4-2-1-3-17(19)5-6-20(22)30-21)13-29-23(27)24-9-15-7-16(10-24)12-25(28,11-15)14-24/h1-6,8,15-16,28H,7,9-14H2/t15-,16+,24?,25?