phenacyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: phenacyl 3-acetamidoadamantane-1-carboxylate Openeye Name: phenacyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid phenacyl ester IUPAC Name: phenacyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid phenacyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)C4=CC=CC=C4

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25NO4/c1-14(23)22-21-10-15-7-16(11-21)9-20(8-15,13-21)19(25)26-12-18(24)17-5-3-2-4-6-17/h2-6,15-16H,7-13H2,1H3,(H,22,23)