5-ethyl-4-(1-phenylethyl)isoindole-1,3-dione

Systemtic Name: 5-ethyl-4-(1-phenylethyl)isoindole-1,3-dione Openeye Name: 5-ethyl-4-(1-phenylethyl)isoindoline-1,3-dione CAS Name: 5-ethyl-4-(1-phenylethyl)isoindole-1,3-dione IUPAC Name: 5-ethyl-4-(1-phenylethyl)isoindole-1,3-dione Traditional Name: 5-ethyl-4-(1-phenylethyl)isoindoline-1,3-quinone Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C1)C(=O)NC2=O)C(C)C3=CC=CC=C3

Isomeric SMILES

CCC1=C(C2=C(C=C1)C(=O)NC2=O)C(C)C3=CC=CC=C3

InChI

InChI=1S/C18H17NO2/c1-3-12-9-10-14-16(18(21)19-17(14)20)15(12)11(2)13-7-5-4-6-8-13/h4-11H,3H2,1-2H3,(H,19,20,21)