ethyl 6-methyl-2-(phenylmethoxymethyl)-1-azabicyclo[3.3.1]non-6-ene-7-carboxylate

Systemtic Name: ethyl 6-methyl-2-(phenylmethoxymethyl)-1-azabicyclo[3.3.1]non-6-ene-7-carboxylate Openeye Name: ethyl 2-(benzyloxymethyl)-6-methyl-1-azabicyclo[3.3.1]non-6-ene-7-carboxylate CAS Name: 6-methyl-2-(phenylmethoxymethyl)-1-azabicyclo[3.3.1]non-6-ene-7-carboxylic acid ethyl ester IUPAC Name: ethyl 6-methyl-2-(phenylmethoxymethyl)-1-azabicyclo[3.3.1]non-6-ene-7-carboxylate Traditional Name: 2-(benzoxymethyl)-6-methyl-1-azabicyclo[3.3.1]non-6-ene-7-carboxylic acid ethyl ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2CCC(N(C2)C1)COCC3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=C(C2CCC(N(C2)C1)COCC3=CC=CC=C3)C

InChI

InChI=1S/C20H27NO3/c1-3-24-20(22)19-12-21-11-17(15(19)2)9-10-18(21)14-23-13-16-7-5-4-6-8-16/h4-8,17-18H,3,9-14H2,1-2H3