(2S)-2-[(2-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(2-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[(2-methylsulfonylbenzoyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(2-methylsulfonylphenyl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[(2-methylsulfonylbenzoyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(2-mesylbenzoyl)amino]-3-phenyl-propionate Formula: C17H16NO5S- MolecularWeight: 346.37764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)NC(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H17NO5S/c1-24(22,23)15-10-6-5-9-13(15)16(19)18-14(17(20)21)11-12-7-3-2-4-8-12/h2-10,14H,11H2,1H3,(H,18,19)(H,20,21)/p-1/t14-/m0/s1