4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindole-1,3-dione

Systemtic Name: 4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindole-1,3-dione Openeye Name: 4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindoline-1,3-dione CAS Name: 4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindole-1,3-dione IUPAC Name: 4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindole-1,3-dione Traditional Name: 4-[3-(2,3-dihydro-1,4-benzoxathiin-5-yl)propyl]isoindoline-1,3-quinone Formula: C19H17NO3S MolecularWeight: 339.40818

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=C(C=CC=C2O1)CCCC3=CC=CC4=C3C(=O)NC4=O

Isomeric SMILES

C1CSC2=C(C=CC=C2O1)CCCC3=CC=CC4=C3C(=O)NC4=O

InChI

InChI=1S/C19H17NO3S/c21-18-14-8-2-5-12(16(14)19(22)20-18)4-1-6-13-7-3-9-15-17(13)24-11-10-23-15/h2-3,5,7-9H,1,4,6,10-11H2,(H,20,21,22)