N-[2-(hydroxymethyl)-3-thiophen-3-yl-propyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-(hydroxymethyl)-3-thiophen-3-yl-propyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-(hydroxymethyl)-3-(3-thienyl)propyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-(hydroxymethyl)-3-(3-thiophenyl)propyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-(hydroxymethyl)-3-thiophen-3-ylpropyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-methylol-3-(3-thienyl)propyl]-9H-xanthene-9-carboxamide Formula: C22H21NO3S MolecularWeight: 379.47204

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCC(CC4=CSC=C4)CO

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCC(CC4=CSC=C4)CO

InChI

InChI=1S/C22H21NO3S/c24-13-16(11-15-9-10-27-14-15)12-23-22(25)21-17-5-1-3-7-19(17)26-20-8-4-2-6-18(20)21/h1-10,14,16,21,24H,11-13H2,(H,23,25)