2-[4-(3,4-dihydro-2H-thiochromen-8-yloxy)butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-(3,4-dihydro-2H-thiochromen-8-yloxy)butyl]isoindole-1,3-dione Openeye Name: 2-(4-thiochroman-8-yloxybutyl)isoindoline-1,3-dione CAS Name: 2-[4-(3,4-dihydro-2H-1-benzothiopyran-8-yloxy)butyl]isoindole-1,3-dione IUPAC Name: 2-[4-(3,4-dihydro-2H-thiochromen-8-yloxy)butyl]isoindole-1,3-dione Traditional Name: 2-(4-thiochroman-8-yloxybutyl)isoindoline-1,3-quinone Formula: C21H21NO3S MolecularWeight: 367.46134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=CC=C2)OCCCCN3C(=O)C4=CC=CC=C4C3=O)SC1

Isomeric SMILES

C1CC2=C(C(=CC=C2)OCCCCN3C(=O)C4=CC=CC=C4C3=O)SC1

InChI

InChI=1S/C21H21NO3S/c23-20-16-9-1-2-10-17(16)21(24)22(20)12-3-4-13-25-18-11-5-7-15-8-6-14-26-19(15)18/h1-2,5,7,9-11H,3-4,6,8,12-14H2