4-[[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]amino]butanoic acid

Systemtic Name: 4-[[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]amino]butanoic acid Openeye Name: 4-[[5-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]-1-naphthyl]amino]butanoic acid CAS Name: 4-[[5-[(3,4-dimethyl-5-isoxazolyl)sulfamoyl]-1-naphthalenyl]amino]butanoic acid IUPAC Name: 4-[[5-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]naphthalen-1-yl]amino]butanoic acid Traditional Name: 4-[[5-[(3,4-dimethylisoxazol-5-yl)sulfamoyl]-1-naphthyl]amino]butyric acid Formula: C19H21N3O5S MolecularWeight: 403.45214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3NCCCC(=O)O

Isomeric SMILES

CC1=C(ON=C1C)NS(=O)(=O)C2=CC=CC3=C2C=CC=C3NCCCC(=O)O

InChI

InChI=1S/C19H21N3O5S/c1-12-13(2)21-27-19(12)22-28(25,26)17-9-4-6-14-15(17)7-3-8-16(14)20-11-5-10-18(23)24/h3-4,6-9,20,22H,5,10-11H2,1-2H3,(H,23,24)