4-phenyl-4-[phenyl(sulfo)amino]butanoic acid

Systemtic Name: 4-phenyl-4-[phenyl(sulfo)amino]butanoic acid Openeye Name: 4-phenyl-4-(N-sulfoanilino)butanoic acid CAS Name: 4-phenyl-4-(N-sulfoanilino)butanoic acid IUPAC Name: 4-phenyl-4-(N-sulfoanilino)butanoic acid Traditional Name: 4-phenyl-4-(N-sulfoanilino)butyric acid Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC(=O)O)N(C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(CCC(=O)O)N(C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C16H17NO5S/c18-16(19)12-11-15(13-7-3-1-4-8-13)17(23(20,21)22)14-9-5-2-6-10-14/h1-10,15H,11-12H2,(H,18,19)(H,20,21,22)