4-butoxy-5-decoxy-3-oxidanyl-chromen-2-one

Systemtic Name: 4-butoxy-5-decoxy-3-oxidanyl-chromen-2-one Openeye Name: 4-butoxy-5-decoxy-3-hydroxy-chromen-2-one CAS Name: 4-butoxy-5-decoxy-3-hydroxy-1-benzopyran-2-one IUPAC Name: 4-butoxy-5-decoxy-3-hydroxychromen-2-one Traditional Name: 4-butoxy-5-decoxy-3-hydroxy-coumarin Formula: C23H34O5 MolecularWeight: 390.51306

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CC=CC2=C1C(=C(C(=O)O2)O)OCCCC

Isomeric SMILES

CCCCCCCCCCOC1=CC=CC2=C1C(=C(C(=O)O2)O)OCCCC

InChI

InChI=1S/C23H34O5/c1-3-5-7-8-9-10-11-12-17-26-18-14-13-15-19-20(18)22(27-16-6-4-2)21(24)23(25)28-19/h13-15,24H,3-12,16-17H2,1-2H3