3-(3,3-dimethyl-2-oxidanylidene-butoxy)-2-hexyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one

Systemtic Name: 3-(3,3-dimethyl-2-oxidanylidene-butoxy)-2-hexyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Openeye Name: 3-(3,3-dimethyl-2-oxo-butoxy)-2-hexyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one CAS Name: 3-(3,3-dimethyl-2-oxobutoxy)-2-hexyl-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-6-one IUPAC Name: 3-(3,3-dimethyl-2-oxobutoxy)-2-hexyl-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Traditional Name: 2-hexyl-3-(2-keto-3,3-dimethyl-butoxy)-7,8,9,10-tetrahydrobenzo[c]chromen-6-one Formula: C25H34O4 MolecularWeight: 398.53506

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC(=O)C(C)(C)C

Isomeric SMILES

CCCCCCC1=C(C=C2C(=C1)C3=C(CCCC3)C(=O)O2)OCC(=O)C(C)(C)C

InChI

InChI=1S/C25H34O4/c1-5-6-7-8-11-17-14-20-18-12-9-10-13-19(18)24(27)29-22(20)15-21(17)28-16-23(26)25(2,3)4/h14-15H,5-13,16H2,1-4H3