(6-formamido-3'-oxidanyl-1-oxidanylidene-spiro[2-benzofuran-3,9'-xanthene]-5-yl) hexanoate

Systemtic Name: (6-formamido-3'-oxidanyl-1-oxidanylidene-spiro[2-benzofuran-3,9'-xanthene]-5-yl) hexanoate Openeye Name: (6-formamido-3'-hydroxy-1-oxo-spiro[isobenzofuran-3,9'-xanthene]-5-yl) hexanoate CAS Name: hexanoic acid (6-formamido-3'-hydroxy-1-oxo-5-spiro[isobenzofuran-3,9'-xanthene]yl) ester IUPAC Name: (6-formamido-3'-hydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-yl) hexanoate Traditional Name: hexanoic acid (6-formamido-3'-hydroxy-1-keto-spiro[phthalan-3,9'-xanthene]-5-yl) ester Formula: C27H23NO7 MolecularWeight: 473.47402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)OC1=C(C=C2C(=C1)C3(C4=C(C=C(C=C4)O)OC5=CC=CC=C53)OC2=O)NC=O

Isomeric SMILES

CCCCCC(=O)OC1=C(C=C2C(=C1)C3(C4=C(C=C(C=C4)O)OC5=CC=CC=C53)OC2=O)NC=O

InChI

InChI=1S/C27H23NO7/c1-2-3-4-9-25(31)34-24-14-20-17(13-21(24)28-15-29)26(32)35-27(20)18-7-5-6-8-22(18)33-23-12-16(30)10-11-19(23)27/h5-8,10-15,30H,2-4,9H2,1H3,(H,28,29)