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

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl (5R,7S)-3-chloranyladamantane-1-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl (5R,7S)-3-chloroadamantane-1-carboxylate CAS Name: (5R,7S)-3-chloro-1-adamantanecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl (5R,7S)-3-chloroadamantane-1-carboxylate Traditional Name: (5R,7S)-3-chloroadamantane-1-carboxylic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C25H23ClO4 MolecularWeight: 422.90072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H23ClO4/c26-25-11-15-7-16(12-25)10-24(9-15,14-25)23(28)29-13-18-8-21(27)30-20-6-5-17-3-1-2-4-19(17)22(18)20/h1-6,8,15-16H,7,9-14H2/t15-,16+,24?,25?