4-prop-2-enyl-5-(3-thiophen-3-ylphenyl)isoindole-1,3-dione

Systemtic Name: 4-prop-2-enyl-5-(3-thiophen-3-ylphenyl)isoindole-1,3-dione Openeye Name: 4-allyl-5-[3-(3-thienyl)phenyl]isoindoline-1,3-dione CAS Name: 4-prop-2-enyl-5-[3-(3-thiophenyl)phenyl]isoindole-1,3-dione IUPAC Name: 4-prop-2-enyl-5-(3-thiophen-3-ylphenyl)isoindole-1,3-dione Traditional Name: 4-allyl-5-[3-(3-thienyl)phenyl]isoindoline-1,3-quinone Formula: C21H15NO2S MolecularWeight: 345.4143

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC1=C(C=CC2=C1C(=O)NC2=O)C3=CC(=CC=C3)C4=CSC=C4

Isomeric SMILES

C=CCC1=C(C=CC2=C1C(=O)NC2=O)C3=CC(=CC=C3)C4=CSC=C4

InChI

InChI=1S/C21H15NO2S/c1-2-4-17-16(7-8-18-19(17)21(24)22-20(18)23)14-6-3-5-13(11-14)15-9-10-25-12-15/h2-3,5-12H,1,4H2,(H,22,23,24)