N-[1-(4-hydroxyphenyl)-2-(3-oxidanylpyrrolidin-1-yl)ethyl]-N-methyl-9H-xanthene-9-carboxamide

Systemtic Name: N-[1-(4-hydroxyphenyl)-2-(3-oxidanylpyrrolidin-1-yl)ethyl]-N-methyl-9H-xanthene-9-carboxamide Openeye Name: N-[1-(4-hydroxyphenyl)-2-(3-hydroxypyrrolidin-1-yl)ethyl]-N-methyl-9H-xanthene-9-carboxamide CAS Name: N-[1-(4-hydroxyphenyl)-2-(3-hydroxy-1-pyrrolidinyl)ethyl]-N-methyl-9H-xanthene-9-carboxamide IUPAC Name: N-[1-(4-hydroxyphenyl)-2-(3-hydroxypyrrolidin-1-yl)ethyl]-N-methyl-9H-xanthene-9-carboxamide Traditional Name: N-[1-(4-hydroxyphenyl)-2-(3-hydroxypyrrolidino)ethyl]-N-methyl-9H-xanthene-9-carboxamide Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(CN1CCC(C1)O)C2=CC=C(C=C2)O)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

Isomeric SMILES

CN(C(CN1CCC(C1)O)C2=CC=C(C=C2)O)C(=O)C3C4=CC=CC=C4OC5=CC=CC=C35

InChI

InChI=1S/C27H28N2O4/c1-28(23(17-29-15-14-20(31)16-29)18-10-12-19(30)13-11-18)27(32)26-21-6-2-4-8-24(21)33-25-9-5-3-7-22(25)26/h2-13,20,23,26,30-31H,14-17H2,1H3