methyl 9-(2-ethylperoxyethyl)-3-(4-methylphenyl)-9-azabicyclo[4.2.1]nonane-5-carboxylate

Systemtic Name: methyl 9-(2-ethylperoxyethyl)-3-(4-methylphenyl)-9-azabicyclo[4.2.1]nonane-5-carboxylate Openeye Name: methyl 9-(2-ethylperoxyethyl)-3-(p-tolyl)-9-azabicyclo[4.2.1]nonane-5-carboxylate CAS Name: 9-(2-ethyldioxyethyl)-3-(4-methylphenyl)-9-azabicyclo[4.2.1]nonane-5-carboxylic acid methyl ester IUPAC Name: methyl 9-(2-ethylperoxyethyl)-3-(4-methylphenyl)-9-azabicyclo[4.2.1]nonane-5-carboxylate Traditional Name: 9-(2-ethylperoxyethyl)-3-(p-tolyl)-9-azabicyclo[4.2.1]nonane-5-carboxylic acid methyl ester Formula: C21H31NO4 MolecularWeight: 361.47514

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Descriptors Computed from Structure

Canonical SMILES:

CCOOCCN1C2CCC1C(CC(C2)C3=CC=C(C=C3)C)C(=O)OC

Isomeric SMILES

CCOOCCN1C2CCC1C(CC(C2)C3=CC=C(C=C3)C)C(=O)OC

InChI

InChI=1S/C21H31NO4/c1-4-25-26-12-11-22-18-9-10-20(22)19(21(23)24-3)14-17(13-18)16-7-5-15(2)6-8-16/h5-8,17-20H,4,9-14H2,1-3H3