3-[3-(butylamino)-2-oxidanyl-propoxy]xanthen-9-one

Systemtic Name: 3-[3-(butylamino)-2-oxidanyl-propoxy]xanthen-9-one Openeye Name: 3-[3-(butylamino)-2-hydroxy-propoxy]xanthen-9-one CAS Name: 3-[3-(butylamino)-2-hydroxypropoxy]-9-xanthenone IUPAC Name: 3-[3-(butylamino)-2-hydroxypropoxy]xanthen-9-one Traditional Name: 3-[3-(butylamino)-2-hydroxy-propoxy]xanthone Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3O2)O

Isomeric SMILES

CCCCNCC(COC1=CC2=C(C=C1)C(=O)C3=CC=CC=C3O2)O

InChI

InChI=1S/C20H23NO4/c1-2-3-10-21-12-14(22)13-24-15-8-9-17-19(11-15)25-18-7-5-4-6-16(18)20(17)23/h4-9,11,14,21-22H,2-3,10,12-13H2,1H3