ethyl 5-[7-methyl-7-oxidanyl-6,8-bis(oxidanylidene)isochromen-3-yl]pentanoate

Systemtic Name: ethyl 5-[7-methyl-7-oxidanyl-6,8-bis(oxidanylidene)isochromen-3-yl]pentanoate Openeye Name: ethyl 5-(7-hydroxy-7-methyl-6,8-dioxo-isochromen-3-yl)pentanoate CAS Name: 5-(7-hydroxy-7-methyl-6,8-dioxo-2-benzopyran-3-yl)pentanoic acid ethyl ester IUPAC Name: ethyl 5-(7-hydroxy-7-methyl-6,8-dioxoisochromen-3-yl)pentanoate Traditional Name: 5-(7-hydroxy-6,8-diketo-7-methyl-isochromen-3-yl)valeric acid ethyl ester Formula: C17H20O6 MolecularWeight: 320.3371

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCC1=CC2=CC(=O)C(C(=O)C2=CO1)(C)O

Isomeric SMILES

CCOC(=O)CCCCC1=CC2=CC(=O)C(C(=O)C2=CO1)(C)O

InChI

InChI=1S/C17H20O6/c1-3-22-15(19)7-5-4-6-12-8-11-9-14(18)17(2,21)16(20)13(11)10-23-12/h8-10,21H,3-7H2,1-2H3