lithium 2-[[4-[cyclohexyl(methoxy)methyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: lithium 2-[[4-[cyclohexyl(methoxy)methyl]-2-(2-methylphenyl)phenyl]carbonylamino]-4-methylsulfanyl-butanoic acid Openeye Name: lithium 2-[[4-[cyclohexyl(methoxy)methyl]-2-(o-tolyl)benzoyl]amino]-4-methylsulfanyl-butanoic acid CAS Name: lithium 2-[[[4-[cyclohexyl(methoxy)methyl]-2-(2-methylphenyl)phenyl]-oxomethyl]amino]-4-(methylthio)butanoic acid IUPAC Name: lithium 2-[[4-[cyclohexyl(methoxy)methyl]-2-(2-methylphenyl)benzoyl]amino]-4-methylsulfanylbutanoic acid Traditional Name: lithium 2-[[4-[cyclohexyl(methoxy)methyl]-2-(o-tolyl)benzoyl]amino]-4-(methylthio)butyric acid Formula: C27H35LiNO4S+ MolecularWeight: 476.5771

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3CCCCC3)OC)C(=O)NC(CCSC)C(=O)O

Isomeric SMILES

[Li+].CC1=CC=CC=C1C2=C(C=CC(=C2)C(C3CCCCC3)OC)C(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C27H35NO4S.Li/c1-18-9-7-8-12-21(18)23-17-20(25(32-2)19-10-5-4-6-11-19)13-14-22(23)26(29)28-24(27(30)31)15-16-33-3;/h7-9,12-14,17,19,24-25H,4-6,10-11,15-16H2,1-3H3,(H,28,29)(H,30,31);/q;+1