(2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (5R,7S)-3-chloranyladamantane-1-carboxylate

Systemtic Name: (2-oxidanylidene-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (5R,7S)-3-chloranyladamantane-1-carboxylate Openeye Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (5R,7S)-3-chloroadamantane-1-carboxylate CAS Name: (5R,7S)-3-chloro-1-adamantanecarboxylic acid (2-oxo-7,8-dihydro-6H-cyclopenta[g][1]benzopyran-4-yl)methyl ester IUPAC Name: (2-oxo-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl (5R,7S)-3-chloroadamantane-1-carboxylate Traditional Name: (5R,7S)-3-chloroadamantane-1-carboxylic acid (2-keto-7,8-dihydro-6H-cyclopenta[g]chromen-4-yl)methyl ester Formula: C24H25ClO4 MolecularWeight: 412.9059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)COC(=O)C45CC6CC(C4)CC(C6)(C5)Cl

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CC(=O)O3)COC(=O)C45C[C@H]6C[C@@H](C4)CC(C6)(C5)Cl

InChI

InChI=1S/C24H25ClO4/c25-24-10-14-4-15(11-24)9-23(8-14,13-24)22(27)28-12-18-7-21(26)29-20-6-17-3-1-2-16(17)5-19(18)20/h5-7,14-15H,1-4,8-13H2/t14-,15+,23?,24?