(2E,5E)-16,17-bis(methylsulfanyl)-4-oxidanylidene-tricosa-2,5-dienal

Systemtic Name: (2E,5E)-16,17-bis(methylsulfanyl)-4-oxidanylidene-tricosa-2,5-dienal Openeye Name: (2E,5E)-16,17-bis(methylsulfanyl)-4-oxo-tricosa-2,5-dienal CAS Name: (2E,5E)-16,17-bis(methylthio)-4-oxotricosa-2,5-dienal IUPAC Name: (2E,5E)-16,17-bis(methylsulfanyl)-4-oxotricosa-2,5-dienal Traditional Name: (2E,5E)-4-keto-16,17-bis(methylthio)tricosa-2,5-dienal Formula: C25H44O2S2 MolecularWeight: 440.74566

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(CCCCCCCCCC=CC(=O)C=CC=O)SC)SC

Isomeric SMILES

CCCCCCC(C(CCCCCCCCC/C=C/C(=O)/C=C/C=O)SC)SC

InChI

InChI=1S/C25H44O2S2/c1-4-5-6-15-20-24(28-2)25(29-3)21-16-13-11-9-7-8-10-12-14-18-23(27)19-17-22-26/h14,17-19,22,24-25H,4-13,15-16,20-21H2,1-3H3/b18-14+,19-17+