2-[(4-butylphenyl)methyl]-2-phenacyl-indene-1,3-dione

Systemtic Name: 2-[(4-butylphenyl)methyl]-2-phenacyl-indene-1,3-dione Openeye Name: 2-[(4-butylphenyl)methyl]-2-phenacyl-indane-1,3-dione CAS Name: 2-[(4-butylphenyl)methyl]-2-phenacylindene-1,3-dione IUPAC Name: 2-[(4-butylphenyl)methyl]-2-phenacylindene-1,3-dione Traditional Name: 2-(4-butylbenzyl)-2-phenacyl-indane-1,3-quinone Formula: C28H26O3 MolecularWeight: 410.50424

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC2(C(=O)C3=CC=CC=C3C2=O)CC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC2(C(=O)C3=CC=CC=C3C2=O)CC(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H26O3/c1-2-3-9-20-14-16-21(17-15-20)18-28(19-25(29)22-10-5-4-6-11-22)26(30)23-12-7-8-13-24(23)27(28)31/h4-8,10-17H,2-3,9,18-19H2,1H3