2,2,5-trimethyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(5-phenylpentoxy)chromene-3-carbaldehyde

Systemtic Name: 2,2,5-trimethyl-4-oxidanylidene-3-(3-oxidanylidenebutyl)-7-(5-phenylpentoxy)chromene-3-carbaldehyde Openeye Name: 2,2,5-trimethyl-4-oxo-3-(3-oxobutyl)-7-(5-phenylpentoxy)chromane-3-carbaldehyde CAS Name: 2,2,5-trimethyl-4-oxo-3-(3-oxobutyl)-7-(5-phenylpentoxy)-3,4-dihydro-2H-1-benzopyran-3-carboxaldehyde IUPAC Name: 2,2,5-trimethyl-4-oxo-3-(3-oxobutyl)-7-(5-phenylpentoxy)chromene-3-carbaldehyde Traditional Name: 4-keto-3-(3-ketobutyl)-2,2,5-trimethyl-7-(5-phenylpentoxy)chroman-3-carbaldehyde Formula: C28H34O5 MolecularWeight: 450.56656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC2=C1C(=O)C(C(O2)(C)C)(CCC(=O)C)C=O)OCCCCCC3=CC=CC=C3

Isomeric SMILES

CC1=CC(=CC2=C1C(=O)C(C(O2)(C)C)(CCC(=O)C)C=O)OCCCCCC3=CC=CC=C3

InChI

InChI=1S/C28H34O5/c1-20-17-23(32-16-10-6-9-13-22-11-7-5-8-12-22)18-24-25(20)26(31)28(19-29,15-14-21(2)30)27(3,4)33-24/h5,7-8,11-12,17-19H,6,9-10,13-16H2,1-4H3