2-[3-(3-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoic acid

Systemtic Name: 2-[3-(3-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoic acid Openeye Name: 2-[3-(3-methoxyphenyl)propanoylamino]-4-methylsulfanyl-butanoic acid CAS Name: 2-[[3-(3-methoxyphenyl)-1-oxopropyl]amino]-4-(methylthio)butanoic acid IUPAC Name: 2-[3-(3-methoxyphenyl)propanoylamino]-4-methylsulfanylbutanoic acid Traditional Name: 2-[3-(3-methoxyphenyl)propanoylamino]-4-(methylthio)butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CCC(=O)NC(CCSC)C(=O)O

Isomeric SMILES

COC1=CC=CC(=C1)CCC(=O)NC(CCSC)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-20-12-5-3-4-11(10-12)6-7-14(17)16-13(15(18)19)8-9-21-2/h3-5,10,13H,6-9H2,1-2H3,(H,16,17)(H,18,19)