lithium 2-[[2-(2-methylphenyl)-4-[(3-propoxyphenyl)methoxymethyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate

Systemtic Name: lithium 2-[[2-(2-methylphenyl)-4-[(3-propoxyphenyl)methoxymethyl]phenyl]carbonylamino]-4-methylsulfanyl-butanoate Openeye Name: lithium 4-methylsulfanyl-2-[[2-(o-tolyl)-4-[(3-propoxyphenyl)methoxymethyl]benzoyl]amino]butanoate CAS Name: lithium 2-[[[2-(2-methylphenyl)-4-[(3-propoxyphenyl)methoxymethyl]phenyl]-oxomethyl]amino]-4-(methylthio)butanoate IUPAC Name: lithium 2-[[2-(2-methylphenyl)-4-[(3-propoxyphenyl)methoxymethyl]benzoyl]amino]-4-methylsulfanylbutanoate Traditional Name: lithium 4-(methylthio)-2-[[2-(o-tolyl)-4-[(3-propoxybenzyl)oxymethyl]benzoyl]amino]butyrate Formula: C30H34LiNO5S MolecularWeight: 527.60066

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Descriptors Computed from Structure

Canonical SMILES:

[Li+].CCCOC1=CC=CC(=C1)COCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)[O-])C3=CC=CC=C3C

Isomeric SMILES

[Li+].CCCOC1=CC=CC(=C1)COCC2=CC(=C(C=C2)C(=O)NC(CCSC)C(=O)[O-])C3=CC=CC=C3C

InChI

InChI=1S/C30H35NO5S.Li/c1-4-15-36-24-10-7-9-22(17-24)19-35-20-23-12-13-26(27(18-23)25-11-6-5-8-21(25)2)29(32)31-28(30(33)34)14-16-37-3;/h5-13,17-18,28H,4,14-16,19-20H2,1-3H3,(H,31,32)(H,33,34);/q;+1/p-1