methyl 3-(3-bromanyl-4-ethyl-phenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate

Systemtic Name: methyl 3-(3-bromanyl-4-ethyl-phenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Openeye Name: methyl 3-(3-bromo-4-ethyl-phenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate CAS Name: 3-(3-bromo-4-ethylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester IUPAC Name: methyl 3-(3-bromo-4-ethylphenyl)-8-azabicyclo[3.2.1]octane-4-carboxylate Traditional Name: 3-(3-bromo-4-ethyl-phenyl)-8-azabicyclo[3.2.1]octane-4-carboxylic acid methyl ester Formula: C17H22BrNO2 MolecularWeight: 352.26608

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C2CC3CCC(C2C(=O)OC)N3)Br

Isomeric SMILES

CCC1=C(C=C(C=C1)C2CC3CCC(C2C(=O)OC)N3)Br

InChI

InChI=1S/C17H22BrNO2/c1-3-10-4-5-11(8-14(10)18)13-9-12-6-7-15(19-12)16(13)17(20)21-2/h4-5,8,12-13,15-16,19H,3,6-7,9H2,1-2H3