2-[9-oxidanylidene-6-(3-piperidin-1-ylpropoxy)xanthen-4-yl]ethanoic acid

Systemtic Name: 2-[9-oxidanylidene-6-(3-piperidin-1-ylpropoxy)xanthen-4-yl]ethanoic acid Openeye Name: 2-[9-oxo-6-[3-(1-piperidyl)propoxy]xanthen-4-yl]acetic acid CAS Name: 2-[9-oxo-6-[3-(1-piperidinyl)propoxy]-4-xanthenyl]acetic acid IUPAC Name: 2-[9-oxo-6-(3-piperidin-1-ylpropoxy)xanthen-4-yl]acetic acid Traditional Name: 2-[9-keto-6-(3-piperidinopropoxy)xanthen-4-yl]acetic acid Formula: C23H25NO5 MolecularWeight: 395.4483

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C(=CC=C4)CC(=O)O

Isomeric SMILES

C1CCN(CC1)CCCOC2=CC3=C(C=C2)C(=O)C4=C(O3)C(=CC=C4)CC(=O)O

InChI

InChI=1S/C23H25NO5/c25-21(26)14-16-6-4-7-19-22(27)18-9-8-17(15-20(18)29-23(16)19)28-13-5-12-24-10-2-1-3-11-24/h4,6-9,15H,1-3,5,10-14H2,(H,25,26)