[2-ethanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] adamantane-1-carboxylate

Systemtic Name: [2-ethanoyl-4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] adamantane-1-carboxylate Openeye Name: [2-acetyl-4-(2-methoxy-2-oxo-ethyl)phenyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-acetyl-4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [2-acetyl-4-(2-methoxy-2-oxoethyl)phenyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-acetyl-4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C22H26O5 MolecularWeight: 370.43884

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=CC(=C1)CC(=O)OC)OC(=O)C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CC(=O)C1=C(C=CC(=C1)CC(=O)OC)OC(=O)C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C22H26O5/c1-13(23)18-8-14(9-20(24)26-2)3-4-19(18)27-21(25)22-10-15-5-16(11-22)7-17(6-15)12-22/h3-4,8,15-17H,5-7,9-12H2,1-2H3