(7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: (7-ethyl-2-oxidanylidene-chromen-4-yl)methyl 3-acetamidoadamantane-1-carboxylate Openeye Name: (7-ethyl-2-oxo-chromen-4-yl)methyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid (7-ethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-ethyl-2-oxochromen-4-yl)methyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid (7-ethyl-2-keto-chromen-4-yl)methyl ester Formula: C25H29NO5 MolecularWeight: 423.50146

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)COC(=O)C34CC5CC(C3)CC(C5)(C4)NC(=O)C

InChI

InChI=1S/C25H29NO5/c1-3-16-4-5-20-19(8-22(28)31-21(20)7-16)13-30-23(29)24-9-17-6-18(10-24)12-25(11-17,14-24)26-15(2)27/h4-5,7-8,17-18H,3,6,9-14H2,1-2H3,(H,26,27)