lithium 2-[[4-[2-[(4-chlorophenyl)methoxy]ethoxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: lithium 2-[[4-[2-[(4-chlorophenyl)methoxy]ethoxymethyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: lithium 2-[[4-[2-[(4-chlorophenyl)methoxy]ethoxymethyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: lithium 2-[[[4-[2-[(4-chlorophenyl)methoxy]ethoxymethyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: lithium 2-[[4-[2-[(4-chlorophenyl)methoxy]ethoxymethyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: lithium 2-[[4-[2-(4-chlorobenzyl)oxyethoxymethyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid Formula: C29H32ClLiNO5S+ MolecularWeight: 549.02708

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)COCCOCC3=CC=C(C=C3)Cl)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)COCCOCC3=CC=C(C=C3)Cl)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C29H32ClNO5S.Li/c1-20-5-3-4-6-24(20)26-17-22(19-36-15-14-35-18-21-7-10-23(30)11-8-21)9-12-25(26)28(32)31-27(29(33)34)13-16-37-2;/h3-12,17,27H,13-16,18-19H2,1-2H3,(H,31,32)(H,33,34);/q;+1