2-(1-tridecoxyethoxy)benzenecarbothioic S-acid

Systemtic Name: 2-(1-tridecoxyethoxy)benzenecarbothioic S-acid Openeye Name: 2-(1-tridecoxyethoxy)benzenecarbothioic S-acid CAS Name: 2-(1-tridecoxyethoxy)benzenecarbothioic S-acid IUPAC Name: 2-(1-tridecoxyethoxy)benzenecarbothioic S-acid Traditional Name: 2-(1-tridecoxyethoxy)thiobenzoic acid Formula: C22H36O3S MolecularWeight: 380.58444

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCOC(C)OC1=CC=CC=C1C(=O)S

Isomeric SMILES

CCCCCCCCCCCCCOC(C)OC1=CC=CC=C1C(=O)S

InChI

InChI=1S/C22H36O3S/c1-3-4-5-6-7-8-9-10-11-12-15-18-24-19(2)25-21-17-14-13-16-20(21)22(23)26/h13-14,16-17,19H,3-12,15,18H2,1-2H3,(H,23,26)