1-[(2S)-2-(cyclohexen-1-ylcarbonyl)pyrrolidin-1-yl]-4-phenyl-butan-1-one

Systemtic Name: 1-[(2S)-2-(cyclohexen-1-ylcarbonyl)pyrrolidin-1-yl]-4-phenyl-butan-1-one Openeye Name: 1-[(2S)-2-(cyclohexene-1-carbonyl)pyrrolidin-1-yl]-4-phenyl-butan-1-one CAS Name: 1-[(2S)-2-[1-cyclohexenyl(oxo)methyl]-1-pyrrolidinyl]-4-phenyl-1-butanone IUPAC Name: 1-[(2S)-2-(cyclohexene-1-carbonyl)pyrrolidin-1-yl]-4-phenylbutan-1-one Traditional Name: 1-[(2S)-2-(cyclohexene-1-carbonyl)pyrrolidino]-4-phenyl-butan-1-one Formula: C21H27NO2 MolecularWeight: 325.44458

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CC1)C(=O)C2CCCN2C(=O)CCCC3=CC=CC=C3

Isomeric SMILES

C1CCC(=CC1)C(=O)[C@@H]2CCCN2C(=O)CCCC3=CC=CC=C3

InChI

InChI=1S/C21H27NO2/c23-20(15-7-11-17-9-3-1-4-10-17)22-16-8-14-19(22)21(24)18-12-5-2-6-13-18/h1,3-4,9-10,12,19H,2,5-8,11,13-16H2/t19-/m0/s1