[4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate

Systemtic Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate Openeye Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]methyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-thiazolyl]methyl ester IUPAC Name: [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1,3-thiazol-2-yl]methyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)thiazol-2-yl]methyl ester Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCC1=NC(=CS1)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C)(C)C(=O)OCC1=NC(=CS1)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H21NO4S/c1-18(2,3)17(20)23-10-16-19-13(11-24-16)12-5-6-14-15(9-12)22-8-4-7-21-14/h5-6,9,11H,4,7-8,10H2,1-3H3