methyl (1S,5R)-3-phenyl-8-(propylcarbamoyl)-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate

Systemtic Name: methyl (1S,5R)-3-phenyl-8-(propylcarbamoyl)-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate Openeye Name: methyl (1S,5R)-3-phenyl-8-(propylcarbamoyl)-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate CAS Name: (1S,5R)-8-[oxo(propylamino)methyl]-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,5R)-3-phenyl-8-(propylcarbamoyl)-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate Traditional Name: (1S,5R)-3-phenyl-8-(propylcarbamoyl)-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylic acid methyl ester Formula: C19H24N2O3 MolecularWeight: 328.40546

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1C2CCC1C(=C(C2)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CCCNC(=O)N1[C@H]2CC[C@@H]1C(=C(C2)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C19H24N2O3/c1-3-11-20-19(23)21-14-9-10-16(21)17(18(22)24-2)15(12-14)13-7-5-4-6-8-13/h4-8,14,16H,3,9-12H2,1-2H3,(H,20,23)/t14-,16+/m0/s1