ethyl 2-[6-[butyl-(phenylmethyl)sulfamoyl]-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[6-[butyl-(phenylmethyl)sulfamoyl]-2-oxidanylidene-1,3-benzoxazol-3-yl]ethanoate Openeye Name: ethyl 2-[6-[benzyl(butyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3-yl]acetate CAS Name: 2-[6-[butyl-(phenylmethyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[6-[benzyl(butyl)sulfamoyl]-2-oxo-1,3-benzoxazol-3-yl]acetate Traditional Name: 2-[6-[benzyl(butyl)sulfamoyl]-2-keto-1,3-benzoxazol-3-yl]acetic acid ethyl ester Formula: C22H26N2O6S MolecularWeight: 446.51664

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)OCC

Isomeric SMILES

CCCCN(CC1=CC=CC=C1)S(=O)(=O)C2=CC3=C(C=C2)N(C(=O)O3)CC(=O)OCC

InChI

InChI=1S/C22H26N2O6S/c1-3-5-13-23(15-17-9-7-6-8-10-17)31(27,28)18-11-12-19-20(14-18)30-22(26)24(19)16-21(25)29-4-2/h6-12,14H,3-5,13,15-16H2,1-2H3