2-[(5-propanoylthiophen-2-yl)methyl]isoindole-1,3-dione

Systemtic Name: 2-[(5-propanoylthiophen-2-yl)methyl]isoindole-1,3-dione Openeye Name: 2-[(5-propanoyl-2-thienyl)methyl]isoindoline-1,3-dione CAS Name: 2-[[5-(1-oxopropyl)-2-thiophenyl]methyl]isoindole-1,3-dione IUPAC Name: 2-[(5-propanoylthiophen-2-yl)methyl]isoindole-1,3-dione Traditional Name: 2-[(5-propionyl-2-thienyl)methyl]isoindoline-1,3-quinone Formula: C16H13NO3S MolecularWeight: 299.34432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(S1)CN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCC(=O)C1=CC=C(S1)CN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C16H13NO3S/c1-2-13(18)14-8-7-10(21-14)9-17-15(19)11-5-3-4-6-12(11)16(17)20/h3-8H,2,9H2,1H3