2-[(Z)-3-(hydroxymethyl)-4-methylidene-1-oxidanyl-undec-2-en-5-yl]isoindole-1,3-dione

Systemtic Name: 2-[(Z)-3-(hydroxymethyl)-4-methylidene-1-oxidanyl-undec-2-en-5-yl]isoindole-1,3-dione Openeye Name: 2-[1-[(Z)-4-hydroxy-2-(hydroxymethyl)-1-methylene-but-2-enyl]heptyl]isoindoline-1,3-dione CAS Name: 2-[(Z)-1-hydroxy-3-(hydroxymethyl)-4-methyleneundec-2-en-5-yl]isoindole-1,3-dione IUPAC Name: 2-[(Z)-1-hydroxy-3-(hydroxymethyl)-4-methylideneundec-2-en-5-yl]isoindole-1,3-dione Traditional Name: 2-[(Z)-1-hexyl-5-hydroxy-2-methylene-3-methylol-pent-3-enyl]isoindoline-1,3-quinone Formula: C21H27NO4 MolecularWeight: 357.44338

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=C)C(=CCO)CO)N1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CCCCCCC(C(=C)/C(=C/CO)/CO)N1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C21H27NO4/c1-3-4-5-6-11-19(15(2)16(14-24)12-13-23)22-20(25)17-9-7-8-10-18(17)21(22)26/h7-10,12,19,23-24H,2-6,11,13-14H2,1H3/b16-12+