(3S)-3-oxidanyl-2-[(1R)-2-oxidanyl-1-phenyl-ethyl]-3-pent-4-enyl-isoindol-1-one

Systemtic Name: (3S)-3-oxidanyl-2-[(1R)-2-oxidanyl-1-phenyl-ethyl]-3-pent-4-enyl-isoindol-1-one Openeye Name: (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-pent-4-enyl-isoindolin-1-one CAS Name: (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenylethyl]-3-pent-4-enyl-1-isoindolone IUPAC Name: (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenylethyl]-3-pent-4-enylisoindol-1-one Traditional Name: (3S)-3-hydroxy-2-[(1R)-2-hydroxy-1-phenyl-ethyl]-3-pent-4-enyl-isoindolin-1-one Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCC1(C2=CC=CC=C2C(=O)N1C(CO)C3=CC=CC=C3)O

Isomeric SMILES

C=CCCC[C@@]1(C2=CC=CC=C2C(=O)N1[C@@H](CO)C3=CC=CC=C3)O

InChI

InChI=1S/C21H23NO3/c1-2-3-9-14-21(25)18-13-8-7-12-17(18)20(24)22(21)19(15-23)16-10-5-4-6-11-16/h2,4-8,10-13,19,23,25H,1,3,9,14-15H2/t19-,21-/m0/s1