2-(4-methoxyphenyl)ethyl 3-acetamidoadamantane-1-carboxylate

Systemtic Name: 2-(4-methoxyphenyl)ethyl 3-acetamidoadamantane-1-carboxylate Openeye Name: 2-(4-methoxyphenyl)ethyl 3-acetamidoadamantane-1-carboxylate CAS Name: 3-acetamido-1-adamantanecarboxylic acid 2-(4-methoxyphenyl)ethyl ester IUPAC Name: 2-(4-methoxyphenyl)ethyl 3-acetamidoadamantane-1-carboxylate Traditional Name: 3-acetamidoadamantane-1-carboxylic acid 2-(4-methoxyphenyl)ethyl ester Formula: C22H29NO4 MolecularWeight: 371.46996

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCCC4=CC=C(C=C4)OC

Isomeric SMILES

CC(=O)NC12CC3CC(C1)CC(C3)(C2)C(=O)OCCC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H29NO4/c1-15(24)23-22-12-17-9-18(13-22)11-21(10-17,14-22)20(25)27-8-7-16-3-5-19(26-2)6-4-16/h3-6,17-18H,7-14H2,1-2H3,(H,23,24)