2-hexadecoxysulfinylbenzoic acid

Systemtic Name: 2-hexadecoxysulfinylbenzoic acid Openeye Name: 2-hexadecoxysulfinylbenzoic acid CAS Name: 2-hexadecoxysulfinylbenzoic acid IUPAC Name: 2-hexadecoxysulfinylbenzoic acid Traditional Name: 2-cetyloxysulfinylbenzoic acid Formula: C23H38O4S MolecularWeight: 410.61042

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOS(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCOS(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C23H38O4S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-17-20-27-28(26)22-19-16-15-18-21(22)23(24)25/h15-16,18-19H,2-14,17,20H2,1H3,(H,24,25)