4-[2-cyclobutyloxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid

Systemtic Name: 4-[2-cyclobutyloxy-5-(phenylmethyl)phenyl]-2,4-bis(oxidanylidene)butanoic acid Openeye Name: 4-[5-benzyl-2-(cyclobutoxy)phenyl]-2,4-dioxo-butanoic acid CAS Name: 4-[2-cyclobutyloxy-5-(phenylmethyl)phenyl]-2,4-dioxobutanoic acid IUPAC Name: 4-(5-benzyl-2-cyclobutyloxyphenyl)-2,4-dioxobutanoic acid Traditional Name: 4-[5-benzyl-2-(cyclobutoxy)phenyl]-2,4-diketo-butyric acid Formula: C21H20O5 MolecularWeight: 352.3805

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)OC2=C(C=C(C=C2)CC3=CC=CC=C3)C(=O)CC(=O)C(=O)O

Isomeric SMILES

C1CC(C1)OC2=C(C=C(C=C2)CC3=CC=CC=C3)C(=O)CC(=O)C(=O)O

InChI

InChI=1S/C21H20O5/c22-18(13-19(23)21(24)25)17-12-15(11-14-5-2-1-3-6-14)9-10-20(17)26-16-7-4-8-16/h1-3,5-6,9-10,12,16H,4,7-8,11,13H2,(H,24,25)