2-azanyl-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenyl-benzoic acid

Systemtic Name: 2-azanyl-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenyl-benzoic acid Openeye Name: 2-amino-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenyl-benzoic acid CAS Name: 2-amino-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenylbenzoic acid IUPAC Name: 2-amino-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenylbenzoic acid Traditional Name: 2-amino-4-(4-hydroxyphenyl)sulfonyl-5,6-dimethyl-3-phenyl-benzoic acid Formula: C21H19NO5S MolecularWeight: 397.44426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C(=C1C)S(=O)(=O)C2=CC=C(C=C2)O)C3=CC=CC=C3)N)C(=O)O

Isomeric SMILES

CC1=C(C(=C(C(=C1C)S(=O)(=O)C2=CC=C(C=C2)O)C3=CC=CC=C3)N)C(=O)O

InChI

InChI=1S/C21H19NO5S/c1-12-13(2)20(28(26,27)16-10-8-15(23)9-11-16)18(14-6-4-3-5-7-14)19(22)17(12)21(24)25/h3-11,23H,22H2,1-2H3,(H,24,25)