[6-acetyloxy-9-ethoxy-9-[3-oxidanylidene-3-(4-oxidanylpiperidin-1-yl)propyl]xanthen-3-yl] ethanoate

Systemtic Name: [6-acetyloxy-9-ethoxy-9-[3-oxidanylidene-3-(4-oxidanylpiperidin-1-yl)propyl]xanthen-3-yl] ethanoate Openeye Name: [6-acetoxy-9-ethoxy-9-[3-(4-hydroxy-1-piperidyl)-3-oxo-propyl]xanthen-3-yl] acetate CAS Name: acetic acid [6-acetyloxy-9-ethoxy-9-[3-(4-hydroxy-1-piperidinyl)-3-oxopropyl]-3-xanthenyl] ester IUPAC Name: [6-acetyloxy-9-ethoxy-9-[3-(4-hydroxypiperidin-1-yl)-3-oxopropyl]xanthen-3-yl] acetate Traditional Name: acetic acid [6-acetoxy-9-ethoxy-9-[3-(4-hydroxypiperidino)-3-keto-propyl]xanthen-3-yl] ester Formula: C27H31NO8 MolecularWeight: 497.53694

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1(C2=C(C=C(C=C2)OC(=O)C)OC3=C1C=CC(=C3)OC(=O)C)CCC(=O)N4CCC(CC4)O

Isomeric SMILES

CCOC1(C2=C(C=C(C=C2)OC(=O)C)OC3=C1C=CC(=C3)OC(=O)C)CCC(=O)N4CCC(CC4)O

InChI

InChI=1S/C27H31NO8/c1-4-33-27(12-9-26(32)28-13-10-19(31)11-14-28)22-7-5-20(34-17(2)29)15-24(22)36-25-16-21(35-18(3)30)6-8-23(25)27/h5-8,15-16,19,31H,4,9-14H2,1-3H3