2-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]ethanoate

Systemtic Name: 2-[(2-hexyl-6-oxidanylidene-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]ethanoate Openeye Name: 2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetate CAS Name: 2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c][1]benzopyran-3-yl)oxy]acetate IUPAC Name: 2-[(2-hexyl-6-oxo-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetate Traditional Name: 2-[(2-hexyl-6-keto-7,8,9,10-tetrahydrobenzo[c]chromen-3-yl)oxy]acetate Formula: C21H25O5- MolecularWeight: 357.4202

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H26O5/c1-2-3-4-5-8-14-11-17-15-9-6-7-10-16(15)21(24)26-19(17)12-18(14)25-13-20(22)23/h11-12H,2-10,13H2,1H3,(H,22,23)/p-1