6-(hydroxymethyl)-3-(5-indol-1-ylpentoxy)-2-[(E)-prop-1-enyl]pyran-4-one

Systemtic Name: 6-(hydroxymethyl)-3-(5-indol-1-ylpentoxy)-2-[(E)-prop-1-enyl]pyran-4-one Openeye Name: 6-(hydroxymethyl)-3-(5-indol-1-ylpentoxy)-2-[(E)-prop-1-enyl]pyran-4-one CAS Name: 6-(hydroxymethyl)-3-[5-(1-indolyl)pentoxy]-2-[(E)-prop-1-enyl]-4-pyranone IUPAC Name: 6-(hydroxymethyl)-3-(5-indol-1-ylpentoxy)-2-[(E)-prop-1-enyl]pyran-4-one Traditional Name: 3-(5-indol-1-ylpentoxy)-6-methylol-2-[(E)-prop-1-enyl]pyran-4-one Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C(C(=O)C=C(O1)CO)OCCCCCN2C=CC3=CC=CC=C32

Isomeric SMILES

C/C=C/C1=C(C(=O)C=C(O1)CO)OCCCCCN2C=CC3=CC=CC=C32

InChI

InChI=1S/C22H25NO4/c1-2-8-21-22(20(25)15-18(16-24)27-21)26-14-7-3-6-12-23-13-11-17-9-4-5-10-19(17)23/h2,4-5,8-11,13,15,24H,3,6-7,12,14,16H2,1H3/b8-2+