2-[1-(3,4-diethylphenyl)-3-oxidanyl-propyl]isoindole-1,3-dione

Systemtic Name: 2-[1-(3,4-diethylphenyl)-3-oxidanyl-propyl]isoindole-1,3-dione Openeye Name: 2-[1-(3,4-diethylphenyl)-3-hydroxy-propyl]isoindoline-1,3-dione CAS Name: 2-[1-(3,4-diethylphenyl)-3-hydroxypropyl]isoindole-1,3-dione IUPAC Name: 2-[1-(3,4-diethylphenyl)-3-hydroxypropyl]isoindole-1,3-dione Traditional Name: 2-[1-(3,4-diethylphenyl)-3-hydroxy-propyl]isoindoline-1,3-quinone Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C=C1)C(CCO)N2C(=O)C3=CC=CC=C3C2=O)CC

Isomeric SMILES

CCC1=C(C=C(C=C1)C(CCO)N2C(=O)C3=CC=CC=C3C2=O)CC

InChI

InChI=1S/C21H23NO3/c1-3-14-9-10-16(13-15(14)4-2)19(11-12-23)22-20(24)17-7-5-6-8-18(17)21(22)25/h5-10,13,19,23H,3-4,11-12H2,1-2H3