(2S)-2-[(4-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(4-methylsulfonylphenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[(4-methylsulfonylbenzoyl)amino]-3-phenyl-propanoate CAS Name: (2S)-2-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-3-phenylpropanoate IUPAC Name: (2S)-2-[(4-methylsulfonylbenzoyl)amino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4-mesylbenzoyl)amino]-3-phenyl-propionate Formula: C17H16NO5S- MolecularWeight: 346.37764

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H17NO5S/c1-24(22,23)14-9-7-13(8-10-14)16(19)18-15(17(20)21)11-12-5-3-2-4-6-12/h2-10,15H,11H2,1H3,(H,18,19)(H,20,21)/p-1/t15-/m0/s1