2-(hydroxymethyl)-5-[5-(3-methylindol-1-yl)pentoxy]pyran-4-one

Systemtic Name: 2-(hydroxymethyl)-5-[5-(3-methylindol-1-yl)pentoxy]pyran-4-one Openeye Name: 2-(hydroxymethyl)-5-[5-(3-methylindol-1-yl)pentoxy]pyran-4-one CAS Name: 2-(hydroxymethyl)-5-[5-(3-methyl-1-indolyl)pentoxy]-4-pyranone IUPAC Name: 2-(hydroxymethyl)-5-[5-(3-methylindol-1-yl)pentoxy]pyran-4-one Traditional Name: 5-[5-(3-methylindol-1-yl)pentoxy]-2-methylol-pyran-4-one Formula: C20H23NO4 MolecularWeight: 341.40092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C2=CC=CC=C12)CCCCCOC3=COC(=CC3=O)CO

Isomeric SMILES

CC1=CN(C2=CC=CC=C12)CCCCCOC3=COC(=CC3=O)CO

InChI

InChI=1S/C20H23NO4/c1-15-12-21(18-8-4-3-7-17(15)18)9-5-2-6-10-24-20-14-25-16(13-22)11-19(20)23/h3-4,7-8,11-12,14,22H,2,5-6,9-10,13H2,1H3