2-[carboxy(3-methylsulfanylpropyl)amino]-4-phenyl-butanoic acid

Systemtic Name: 2-[carboxy(3-methylsulfanylpropyl)amino]-4-phenyl-butanoic acid Openeye Name: 2-[carboxy(3-methylsulfanylpropyl)amino]-4-phenyl-butanoic acid CAS Name: 2-[carboxy-[3-(methylthio)propyl]amino]-4-phenylbutanoic acid IUPAC Name: 2-[carboxy(3-methylsulfanylpropyl)amino]-4-phenylbutanoic acid Traditional Name: 2-[carboxy-[3-(methylthio)propyl]amino]-4-phenyl-butyric acid Formula: C15H21NO4S MolecularWeight: 311.39654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSCCCN(C(CCC1=CC=CC=C1)C(=O)O)C(=O)O

Isomeric SMILES

CSCCCN(C(CCC1=CC=CC=C1)C(=O)O)C(=O)O

InChI

InChI=1S/C15H21NO4S/c1-21-11-5-10-16(15(19)20)13(14(17)18)9-8-12-6-3-2-4-7-12/h2-4,6-7,13H,5,8-11H2,1H3,(H,17,18)(H,19,20)