methyl 3-[[2-methyl-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonyl-phenyl-amino]propanoate

Systemtic Name: methyl 3-[[2-methyl-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonyl-phenyl-amino]propanoate Openeye Name: methyl 3-(N-[2-methyl-5-(3-methylisoxazol-5-yl)phenyl]sulfonylanilino)propanoate CAS Name: 3-(N-[2-methyl-5-(3-methyl-5-isoxazolyl)phenyl]sulfonylanilino)propanoic acid methyl ester IUPAC Name: methyl 3-(N-[2-methyl-5-(3-methyl-1,2-oxazol-5-yl)phenyl]sulfonylanilino)propanoate Traditional Name: 3-(N-[2-methyl-5-(3-methylisoxazol-5-yl)phenyl]sulfonylanilino)propionic acid methyl ester Formula: C21H22N2O5S MolecularWeight: 414.47478

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N(CCC(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C=C(C=C1)C2=CC(=NO2)C)S(=O)(=O)N(CCC(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H22N2O5S/c1-15-9-10-17(19-13-16(2)22-28-19)14-20(15)29(25,26)23(12-11-21(24)27-3)18-7-5-4-6-8-18/h4-10,13-14H,11-12H2,1-3H3