2-[(E)-octadec-9-enoyl]benzenesulfinic acid

Systemtic Name: 2-[(E)-octadec-9-enoyl]benzenesulfinic acid Openeye Name: 2-[(E)-octadec-9-enoyl]benzenesulfinic acid CAS Name: 2-[(E)-1-oxooctadec-9-enyl]benzenesulfinic acid IUPAC Name: 2-[(E)-octadec-9-enoyl]benzenesulfinic acid Traditional Name: 2-[(E)-octadec-9-enoyl]benzenesulfinic acid Formula: C24H38O3S MolecularWeight: 406.62172

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC=CCCCCCCCC(=O)C1=CC=CC=C1S(=O)O

Isomeric SMILES

CCCCCCCC/C=C/CCCCCCCC(=O)C1=CC=CC=C1S(=O)O

InChI

InChI=1S/C24H38O3S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-23(25)22-19-17-18-21-24(22)28(26)27/h9-10,17-19,21H,2-8,11-16,20H2,1H3,(H,26,27)/b10-9+