methyl 3-[[3-(oxolan-2-ylmethylsulfamoyl)phenyl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[3-(oxolan-2-ylmethylsulfamoyl)phenyl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-phenyl-3-[[3-(tetrahydrofuran-2-ylmethylsulfamoyl)benzoyl]amino]propanoate CAS Name: 3-[[oxo-[3-(2-oxolanylmethylsulfamoyl)phenyl]methyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[[3-(oxolan-2-ylmethylsulfamoyl)benzoyl]amino]-3-phenylpropanoate Traditional Name: 3-phenyl-3-[[3-(tetrahydrofurfurylsulfamoyl)benzoyl]amino]propionic acid methyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CCCO3

Isomeric SMILES

COC(=O)CC(C1=CC=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)NCC3CCCO3

InChI

InChI=1S/C22H26N2O6S/c1-29-21(25)14-20(16-7-3-2-4-8-16)24-22(26)17-9-5-11-19(13-17)31(27,28)23-15-18-10-6-12-30-18/h2-5,7-9,11,13,18,20,23H,6,10,12,14-15H2,1H3,(H,24,26)