4-[3-(4-butylphenyl)propyl]isoindole-1,3-dione

Systemtic Name: 4-[3-(4-butylphenyl)propyl]isoindole-1,3-dione Openeye Name: 4-[3-(4-butylphenyl)propyl]isoindoline-1,3-dione CAS Name: 4-[3-(4-butylphenyl)propyl]isoindole-1,3-dione IUPAC Name: 4-[3-(4-butylphenyl)propyl]isoindole-1,3-dione Traditional Name: 4-[3-(4-butylphenyl)propyl]isoindoline-1,3-quinone Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCCC2=CC=CC3=C2C(=O)NC3=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCCC2=CC=CC3=C2C(=O)NC3=O

InChI

InChI=1S/C21H23NO2/c1-2-3-6-15-11-13-16(14-12-15)7-4-8-17-9-5-10-18-19(17)21(24)22-20(18)23/h5,9-14H,2-4,6-8H2,1H3,(H,22,23,24)