ethyl 3-[[4-(2-methylbutan-2-yl)phenyl]sulfonyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[[4-(2-methylbutan-2-yl)phenyl]sulfonyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[4-(1,1-dimethylpropyl)phenyl]sulfonyl-amino]propanoate CAS Name: 3-[[4-(2-methylbutan-2-yl)phenyl]sulfonyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[4-(2-methylbutan-2-yl)phenyl]sulfonylamino]propanoate Traditional Name: 3-[(4-tert-amylphenyl)sulfonyl-benzyl-amino]propionic acid ethyl ester Formula: C23H31NO4S MolecularWeight: 417.56154

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N(CCC(=O)OCC)CC2=CC=CC=C2

InChI

InChI=1S/C23H31NO4S/c1-5-23(3,4)20-12-14-21(15-13-20)29(26,27)24(17-16-22(25)28-6-2)18-19-10-8-7-9-11-19/h7-15H,5-6,16-18H2,1-4H3