3,4-bis(3-ethylsulfanylpropyl)phthalic acid

Systemtic Name: 3,4-bis(3-ethylsulfanylpropyl)phthalic acid Openeye Name: 3,4-bis(3-ethylsulfanylpropyl)phthalic acid CAS Name: 3,4-bis[3-(ethylthio)propyl]phthalic acid IUPAC Name: 3,4-bis(3-ethylsulfanylpropyl)phthalic acid Traditional Name: 3,4-bis[3-(ethylthio)propyl]phthalic acid Formula: C18H26O4S2 MolecularWeight: 370.52664

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCSCC

Isomeric SMILES

CCSCCCC1=C(C(=C(C=C1)C(=O)O)C(=O)O)CCCSCC

InChI

InChI=1S/C18H26O4S2/c1-3-23-11-5-7-13-9-10-15(17(19)20)16(18(21)22)14(13)8-6-12-24-4-2/h9-10H,3-8,11-12H2,1-2H3,(H,19,20)(H,21,22)