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

Systemtic Name: methyl (1S,5R)-8-(cyclohexylcarbamoyl)-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate Openeye Name: methyl (1S,5R)-8-(cyclohexylcarbamoyl)-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate CAS Name: (1S,5R)-8-[(cyclohexylamino)-oxomethyl]-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylic acid methyl ester IUPAC Name: methyl (1S,5R)-8-(cyclohexylcarbamoyl)-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylate Traditional Name: (1S,5R)-8-(cyclohexylcarbamoyl)-3-phenyl-8-azabicyclo[3.2.1]oct-3-ene-4-carboxylic acid methyl ester Formula: C22H28N2O3 MolecularWeight: 368.46932

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(CC2CCC1N2C(=O)NC3CCCCC3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=C(C[C@@H]2CC[C@H]1N2C(=O)NC3CCCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N2O3/c1-27-21(25)20-18(15-8-4-2-5-9-15)14-17-12-13-19(20)24(17)22(26)23-16-10-6-3-7-11-16/h2,4-5,8-9,16-17,19H,3,6-7,10-14H2,1H3,(H,23,26)/t17-,19+/m0/s1