(2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenylpropanoate IUPAC Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2S)-2-[(4-acetamidophenyl)sulfonylamino]-3-phenyl-propionate Formula: C17H17N2O5S- MolecularWeight: 361.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)NC(CC2=CC=CC=C2)C(=O)[O-]

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N[C@@H](CC2=CC=CC=C2)C(=O)[O-]

InChI

InChI=1S/C17H18N2O5S/c1-12(20)18-14-7-9-15(10-8-14)25(23,24)19-16(17(21)22)11-13-5-3-2-4-6-13/h2-10,16,19H,11H2,1H3,(H,18,20)(H,21,22)/p-1/t16-/m0/s1