(2S)-2-[[4-(4-aminophenyl)sulfonylphenyl]amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[[4-(4-aminophenyl)sulfonylphenyl]amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[4-(4-aminophenyl)sulfonylanilino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[4-(4-aminophenyl)sulfonylanilino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[4-(4-aminophenyl)sulfonylanilino]-3-phenylpropanoic acid Traditional Name: (2S)-3-phenyl-2-(4-sulfanilylanilino)propionic acid Formula: C21H20N2O4S MolecularWeight: 396.4595

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)NC2=CC=C(C=C2)S(=O)(=O)C3=CC=C(C=C3)N

InChI

InChI=1S/C21H20N2O4S/c22-16-6-10-18(11-7-16)28(26,27)19-12-8-17(9-13-19)23-20(21(24)25)14-15-4-2-1-3-5-15/h1-13,20,23H,14,22H2,(H,24,25)/t20-/m0/s1