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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=C3C(C4=CC=CC=C4OC3=CC=C2)C(=O)NCCN5CCC(C5)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=C3C(C4=CC=CC=C4OC3=CC=C2)C(=O)NCCN5CCC(C5)O

InChI

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