2-[5-(3-thiophen-3-ylphenoxy)pentyl]isoindole-1,3-dione

Systemtic Name: 2-[5-(3-thiophen-3-ylphenoxy)pentyl]isoindole-1,3-dione Openeye Name: 2-[5-[3-(3-thienyl)phenoxy]pentyl]isoindoline-1,3-dione CAS Name: 2-[5-[3-(3-thiophenyl)phenoxy]pentyl]isoindole-1,3-dione IUPAC Name: 2-[5-(3-thiophen-3-ylphenoxy)pentyl]isoindole-1,3-dione Traditional Name: 2-[5-[3-(3-thienyl)phenoxy]pentyl]isoindoline-1,3-quinone Formula: C23H21NO3S MolecularWeight: 391.48274

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=CC=CC(=C3)C4=CSC=C4

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCCOC3=CC=CC(=C3)C4=CSC=C4

InChI

InChI=1S/C23H21NO3S/c25-22-20-9-2-3-10-21(20)23(26)24(22)12-4-1-5-13-27-19-8-6-7-17(15-19)18-11-14-28-16-18/h2-3,6-11,14-16H,1,4-5,12-13H2