octan-3-yl 7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate

Systemtic Name: octan-3-yl 7-oxidanyl-4-oxidanylidene-chromene-2-carboxylate Openeye Name: 1-ethylhexyl 7-hydroxy-4-oxo-chromene-2-carboxylate CAS Name: 7-hydroxy-4-oxo-1-benzopyran-2-carboxylic acid octan-3-yl ester IUPAC Name: octan-3-yl 7-hydroxy-4-oxochromene-2-carboxylate Traditional Name: 7-hydroxy-4-keto-chromene-2-carboxylic acid 1-ethylhexyl ester Formula: C18H22O5 MolecularWeight: 318.36428

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)OC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O

Isomeric SMILES

CCCCCC(CC)OC(=O)C1=CC(=O)C2=C(O1)C=C(C=C2)O

InChI

InChI=1S/C18H22O5/c1-3-5-6-7-13(4-2)22-18(21)17-11-15(20)14-9-8-12(19)10-16(14)23-17/h8-11,13,19H,3-7H2,1-2H3