methyl (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylate

Systemtic Name: methyl (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylate Openeye Name: methyl (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylate CAS Name: (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylate Traditional Name: (1S,5R)-9-methyl-3-phenyl-9-azabicyclo[3.3.1]non-3-ene-4-carboxylic acid methyl ester Formula: C17H21NO2 MolecularWeight: 271.35414

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2CCCC1C(=C(C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CN1[C@H]2CCC[C@@H]1C(=C(C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C17H21NO2/c1-18-13-9-6-10-15(18)16(17(19)20-2)14(11-13)12-7-4-3-5-8-12/h3-5,7-8,13,15H,6,9-11H2,1-2H3/t13-,15+/m0/s1