lithium 4-[4-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]phenyl]-4-oxidanyl-butanoate

Systemtic Name: lithium 4-[4-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]phenyl]-4-oxidanyl-butanoate Openeye Name: lithium 4-hydroxy-4-[4-[(E)-2-(4-methylthiazol-5-yl)vinyl]phenyl]butanoate CAS Name: lithium 4-hydroxy-4-[4-[(E)-2-(4-methyl-5-thiazolyl)ethenyl]phenyl]butanoate IUPAC Name: lithium 4-hydroxy-4-[4-[(E)-2-(4-methyl-1,3-thiazol-5-yl)ethenyl]phenyl]butanoate Traditional Name: lithium 4-hydroxy-4-[4-[(E)-2-(4-methylthiazol-5-yl)vinyl]phenyl]butyrate Formula: C16H16LiNO3S MolecularWeight: 309.30914

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=C(SC=N1)C=CC2=CC=C(C=C2)C(CCC(=O)[O-])O

Isomeric SMILES

[Li+].CC1=C(SC=N1)/C=C/C2=CC=C(C=C2)C(CCC(=O)[O-])O

InChI

InChI=1S/C16H17NO3S.Li/c1-11-15(21-10-17-11)8-4-12-2-5-13(6-3-12)14(18)7-9-16(19)20;/h2-6,8,10,14,18H,7,9H2,1H3,(H,19,20);/q;+1/p-1/b8-4+;