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4-[1,3-bis(azanyl)-1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-2-phenyl-propyl]benzoic acid

4-[1,3-bis(azanyl)-1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-2-phenyl-propyl]benzoic acid

Systemtic Name:4-[1,3-bis(azanyl)-1-(4-chlorophenyl)sulfonyl-3-oxidanylidene-2-phenyl-propyl]benzoic acid
Openeye Name:4-[1,3-diamino-1-(4-chlorophenyl)sulfonyl-3-oxo-2-phenyl-propyl]benzoic acid
CAS Name:4-[1,3-diamino-1-(4-chlorophenyl)sulfonyl-3-oxo-2-phenylpropyl]benzoic acid
IUPAC Name:4-[1,3-diamino-1-(4-chlorophenyl)sulfonyl-3-oxo-2-phenylpropyl]benzoic acid
Traditional Name:4-[1,3-diamino-1-(4-chlorophenyl)sulfonyl-3-keto-2-phenyl-propyl]benzoic acid
Formula: C22H19ClN2O5S
MolecularWeight: 458.91466
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C22H19ClN2O5S/c23-17-10-12-18(13-11-17)31(29,30)22(25,16-8-6-15(7-9-16)21(27)28)19(20(24)26)14-4-2-1-3-5-14/h1-13,19H,25H2,(H2,24,26)(H,27,28)


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