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2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanoic acid

2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanoic acid

Systemtic Name:2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanoic acid
Openeye Name:2-(benzylsulfonylmethyl)-3-(3-phenylphenyl)propanoic acid
CAS Name:2-[(phenylmethyl)sulfonylmethyl]-3-(3-phenylphenyl)propanoic acid
IUPAC Name:2-(benzylsulfonylmethyl)-3-(3-phenylphenyl)propanoic acid
Traditional Name:2-(benzylsulfonylmethyl)-3-(3-phenylphenyl)propionic acid
Formula: C23H22O4S
MolecularWeight: 394.48338
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)O


Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CC(CC2=CC=CC(=C2)C3=CC=CC=C3)C(=O)O


InChI

InChI=1S/C23H22O4S/c24-23(25)22(17-28(26,27)16-18-8-3-1-4-9-18)15-19-10-7-13-21(14-19)20-11-5-2-6-12-20/h1-14,22H,15-17H2,(H,24,25)


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