2-(3-butoxy-1-oxidanylidene-1-phenyl-propan-2-yl)isoindole-1,3-dione

Systemtic Name: 2-(3-butoxy-1-oxidanylidene-1-phenyl-propan-2-yl)isoindole-1,3-dione Openeye Name: 2-[1-(butoxymethyl)-2-oxo-2-phenyl-ethyl]isoindoline-1,3-dione CAS Name: 2-(3-butoxy-1-oxo-1-phenylpropan-2-yl)isoindole-1,3-dione IUPAC Name: 2-(3-butoxy-1-oxo-1-phenylpropan-2-yl)isoindole-1,3-dione Traditional Name: 2-[1-(butoxymethyl)-2-keto-2-phenyl-ethyl]isoindoline-1,3-quinone Formula: C21H21NO4 MolecularWeight: 351.39574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCC(C(=O)C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCOCC(C(=O)C1=CC=CC=C1)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C21H21NO4/c1-2-3-13-26-14-18(19(23)15-9-5-4-6-10-15)22-20(24)16-11-7-8-12-17(16)21(22)25/h4-12,18H,2-3,13-14H2,1H3