(Z)-2-[3-chloranyl-2-[(2,5-dimethylphenyl)methylsulfanyl]phenyl]-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate

Systemtic Name: (Z)-2-[3-chloranyl-2-[(2,5-dimethylphenyl)methylsulfanyl]phenyl]-3-oxidanyl-3-oxidanylidene-prop-1-en-1-olate Openeye Name: (Z)-2-[3-chloro-2-[(2,5-dimethylphenyl)methylsulfanyl]phenyl]-3-hydroxy-3-oxo-prop-1-en-1-olate CAS Name: (Z)-2-[3-chloro-2-[(2,5-dimethylphenyl)methylthio]phenyl]-3-hydroxy-3-oxo-1-propen-1-olate IUPAC Name: (Z)-2-[3-chloro-2-[(2,5-dimethylphenyl)methylsulfanyl]phenyl]-3-hydroxy-3-oxoprop-1-en-1-olate Traditional Name: (Z)-2-[3-chloro-2-[(2,5-dimethylbenzyl)thio]phenyl]-3-hydroxy-3-keto-prop-1-en-1-olate Formula: C18H16ClO3S- MolecularWeight: 347.83584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=C(C=CC=C2Cl)C(=C[O-])C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=C(C=CC=C2Cl)/C(=C/[O-])/C(=O)O

InChI

InChI=1S/C18H17ClO3S/c1-11-6-7-12(2)13(8-11)10-23-17-14(4-3-5-16(17)19)15(9-20)18(21)22/h3-9,20H,10H2,1-2H3,(H,21,22)/p-1/b15-9-