5-(dibutylamino)-7-methyl-spiro[2-benzofuran-3,9'-xanthene]-1-one

Systemtic Name: 5-(dibutylamino)-7-methyl-spiro[2-benzofuran-3,9'-xanthene]-1-one Openeye Name: 5-(dibutylamino)-7-methyl-spiro[isobenzofuran-3,9'-xanthene]-1-one CAS Name: 5-(dibutylamino)-7-methyl-1-spiro[isobenzofuran-3,9'-xanthene]one IUPAC Name: 5-(dibutylamino)-7-methylspiro[2-benzofuran-3,9'-xanthene]-1-one Traditional Name: 5-(dibutylamino)-7-methyl-spiro[phthalan-3,9'-xanthene]-1-one Formula: C29H31NO3 MolecularWeight: 441.56134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC(=C2C(=C1)C3(C4=CC=CC=C4OC5=CC=CC=C53)OC2=O)C

Isomeric SMILES

CCCCN(CCCC)C1=CC(=C2C(=C1)C3(C4=CC=CC=C4OC5=CC=CC=C53)OC2=O)C

InChI

InChI=1S/C29H31NO3/c1-4-6-16-30(17-7-5-2)21-18-20(3)27-24(19-21)29(33-28(27)31)22-12-8-10-14-25(22)32-26-15-11-9-13-23(26)29/h8-15,18-19H,4-7,16-17H2,1-3H3