2,2,5-trimethyl-3-(3-oxidanylidenebutyl)-7-(2-phenylpentoxy)-3H-chromen-4-one

Systemtic Name: 2,2,5-trimethyl-3-(3-oxidanylidenebutyl)-7-(2-phenylpentoxy)-3H-chromen-4-one Openeye Name: 2,2,5-trimethyl-3-(3-oxobutyl)-7-(2-phenylpentoxy)chroman-4-one CAS Name: 2,2,5-trimethyl-3-(3-oxobutyl)-7-(2-phenylpentoxy)-3,4-dihydro-2H-1-benzopyran-4-one IUPAC Name: 2,2,5-trimethyl-3-(3-oxobutyl)-7-(2-phenylpentoxy)-3H-chromen-4-one Traditional Name: 3-(3-ketobutyl)-2,2,5-trimethyl-7-(2-phenylpentoxy)chroman-4-one Formula: C27H34O4 MolecularWeight: 422.55646

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(COC1=CC2=C(C(=C1)C)C(=O)C(C(O2)(C)C)CCC(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCCC(COC1=CC2=C(C(=C1)C)C(=O)C(C(O2)(C)C)CCC(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C27H34O4/c1-6-10-21(20-11-8-7-9-12-20)17-30-22-15-18(2)25-24(16-22)31-27(4,5)23(26(25)29)14-13-19(3)28/h7-9,11-12,15-16,21,23H,6,10,13-14,17H2,1-5H3