2-[[2-(2-hydroxyphenyl)-1-oxidanyl-ethyl]amino]-3-oxidanyl-6-(phenoxymethyl)-5-propyl-pyran-4-one

Systemtic Name: 2-[[2-(2-hydroxyphenyl)-1-oxidanyl-ethyl]amino]-3-oxidanyl-6-(phenoxymethyl)-5-propyl-pyran-4-one Openeye Name: 3-hydroxy-2-[[1-hydroxy-2-(2-hydroxyphenyl)ethyl]amino]-6-(phenoxymethyl)-5-propyl-pyran-4-one CAS Name: 3-hydroxy-2-[[1-hydroxy-2-(2-hydroxyphenyl)ethyl]amino]-6-(phenoxymethyl)-5-propyl-4-pyranone IUPAC Name: 3-hydroxy-2-[[1-hydroxy-2-(2-hydroxyphenyl)ethyl]amino]-6-(phenoxymethyl)-5-propylpyran-4-one Traditional Name: 3-hydroxy-2-[[1-hydroxy-2-(2-hydroxyphenyl)ethyl]amino]-6-(phenoxymethyl)-5-propyl-pyran-4-one Formula: C23H25NO6 MolecularWeight: 411.4477

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(OC(=C(C1=O)O)NC(CC2=CC=CC=C2O)O)COC3=CC=CC=C3

Isomeric SMILES

CCCC1=C(OC(=C(C1=O)O)NC(CC2=CC=CC=C2O)O)COC3=CC=CC=C3

InChI

InChI=1S/C23H25NO6/c1-2-8-17-19(14-29-16-10-4-3-5-11-16)30-23(22(28)21(17)27)24-20(26)13-15-9-6-7-12-18(15)25/h3-7,9-12,20,24-26,28H,2,8,13-14H2,1H3