(5S)-1-(4-methylphenyl)sulfonyl-5-[(1S)-1-phenylmethoxybut-3-enyl]pyrrolidin-3-one

Systemtic Name: (5S)-1-(4-methylphenyl)sulfonyl-5-[(1S)-1-phenylmethoxybut-3-enyl]pyrrolidin-3-one Openeye Name: (5S)-5-[(1S)-1-benzyloxybut-3-enyl]-1-(p-tolylsulfonyl)pyrrolidin-3-one CAS Name: (5S)-1-(4-methylphenyl)sulfonyl-5-[(1S)-1-phenylmethoxybut-3-enyl]-3-pyrrolidinone IUPAC Name: (5S)-1-(4-methylphenyl)sulfonyl-5-[(1S)-1-phenylmethoxybut-3-enyl]pyrrolidin-3-one Traditional Name: (5S)-5-[(1S)-1-benzoxybut-3-enyl]-1-tosyl-3-pyrrolidone Formula: C22H25NO4S MolecularWeight: 399.5032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)CC2C(CC=C)OCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CC(=O)C[C@H]2[C@H](CC=C)OCC3=CC=CC=C3

InChI

InChI=1S/C22H25NO4S/c1-3-7-22(27-16-18-8-5-4-6-9-18)21-14-19(24)15-23(21)28(25,26)20-12-10-17(2)11-13-20/h3-6,8-13,21-22H,1,7,14-16H2,2H3/t21-,22-/m0/s1