ethyl 4-[(2,2-dimethyl-1,3-benzoxathiol-5-yl)carbonylamino]benzoate

Systemtic Name: ethyl 4-[(2,2-dimethyl-1,3-benzoxathiol-5-yl)carbonylamino]benzoate Openeye Name: ethyl 4-[(2,2-dimethyl-1,3-benzoxathiole-5-carbonyl)amino]benzoate CAS Name: 4-[[(2,2-dimethyl-1,3-benzoxathiol-5-yl)-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(2,2-dimethyl-1,3-benzoxathiole-5-carbonyl)amino]benzoate Traditional Name: 4-[(2,2-dimethyl-1,3-benzoxathiole-5-carbonyl)amino]benzoic acid ethyl ester Formula: C19H19NO4S MolecularWeight: 357.42346

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OC(S3)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=C2)OC(S3)(C)C

InChI

InChI=1S/C19H19NO4S/c1-4-23-18(22)12-5-8-14(9-6-12)20-17(21)13-7-10-15-16(11-13)25-19(2,3)24-15/h5-11H,4H2,1-3H3,(H,20,21)