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3-[3-[(3-hydroxyphenyl)methyl-propyl-amino]propoxy]xanthen-9-one

3-[3-[(3-hydroxyphenyl)methyl-propyl-amino]propoxy]xanthen-9-one

Systemtic Name:3-[3-[(3-hydroxyphenyl)methyl-propyl-amino]propoxy]xanthen-9-one
Openeye Name:3-[3-[(3-hydroxyphenyl)methyl-propyl-amino]propoxy]xanthen-9-one
CAS Name:3-[3-[(3-hydroxyphenyl)methyl-propylamino]propoxy]-9-xanthenone
IUPAC Name:3-[3-[(3-hydroxyphenyl)methyl-propylamino]propoxy]xanthen-9-one
Traditional Name:3-[3-[(3-hydroxybenzyl)-propyl-amino]propoxy]xanthone
Formula: C26H27NO4
MolecularWeight: 417.49688
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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCCOC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3O2)CC4=CC(=CC=C4)O


Isomeric SMILES

CCCN(CCCOC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3O2)CC4=CC(=CC=C4)O


InChI

InChI=1S/C26H27NO4/c1-2-13-27(18-19-7-5-8-20(28)16-19)14-6-15-30-21-11-12-23-25(17-21)31-24-10-4-3-9-22(24)26(23)29/h3-5,7-12,16-17,28H,2,6,13-15,18H2,1H3


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