2-ethyl-2-(2-methoxyphenyl)-4-(3-oxidanylideneheptyl)cyclopentane-1,3-dione

Systemtic Name: 2-ethyl-2-(2-methoxyphenyl)-4-(3-oxidanylideneheptyl)cyclopentane-1,3-dione Openeye Name: 2-ethyl-2-(2-methoxyphenyl)-4-(3-oxoheptyl)cyclopentane-1,3-dione CAS Name: 2-ethyl-2-(2-methoxyphenyl)-4-(3-oxoheptyl)cyclopentane-1,3-dione IUPAC Name: 2-ethyl-2-(2-methoxyphenyl)-4-(3-oxoheptyl)cyclopentane-1,3-dione Traditional Name: 2-ethyl-4-(3-ketoheptyl)-2-(2-methoxyphenyl)cyclopentane-1,3-quinone Formula: C21H28O4 MolecularWeight: 344.44462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)CCC1CC(=O)C(C1=O)(CC)C2=CC=CC=C2OC

Isomeric SMILES

CCCCC(=O)CCC1CC(=O)C(C1=O)(CC)C2=CC=CC=C2OC

InChI

InChI=1S/C21H28O4/c1-4-6-9-16(22)13-12-15-14-19(23)21(5-2,20(15)24)17-10-7-8-11-18(17)25-3/h7-8,10-11,15H,4-6,9,12-14H2,1-3H3