6-oxidanylhexyl 7-methyl-2-oxidanylidene-chromene-3-carboxylate

Systemtic Name: 6-oxidanylhexyl 7-methyl-2-oxidanylidene-chromene-3-carboxylate Openeye Name: 6-hydroxyhexyl 7-methyl-2-oxo-chromene-3-carboxylate CAS Name: 7-methyl-2-oxo-1-benzopyran-3-carboxylic acid 6-hydroxyhexyl ester IUPAC Name: 6-hydroxyhexyl 7-methyl-2-oxochromene-3-carboxylate Traditional Name: 2-keto-7-methyl-chromene-3-carboxylic acid 6-hydroxyhexyl ester Formula: C17H20O5 MolecularWeight: 304.3377

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCCCCCCO

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)OCCCCCCO

InChI

InChI=1S/C17H20O5/c1-12-6-7-13-11-14(17(20)22-15(13)10-12)16(19)21-9-5-3-2-4-8-18/h6-7,10-11,18H,2-5,8-9H2,1H3