(4-phenylphenyl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate

Systemtic Name: (4-phenylphenyl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate Openeye Name: (4-phenylphenyl)methyl 3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propanoate CAS Name: 3-[(3,5-dimethyl-4-isoxazolyl)sulfonylamino]propanoic acid (4-phenylphenyl)methyl ester IUPAC Name: (4-phenylphenyl)methyl 3-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonylamino]propanoate Traditional Name: 3-[(3,5-dimethylisoxazol-4-yl)sulfonylamino]propionic acid (4-phenylbenzyl) ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)NCCC(=O)OCC2=CC=C(C=C2)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-15-21(16(2)28-23-15)29(25,26)22-13-12-20(24)27-14-17-8-10-19(11-9-17)18-6-4-3-5-7-18/h3-11,22H,12-14H2,1-2H3