(3,5-dimethyl-1,2-oxazol-4-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate

Systemtic Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Openeye Name: (3,5-dimethylisoxazol-4-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid (3,5-dimethyl-4-isoxazolyl)methyl ester IUPAC Name: (3,5-dimethyl-1,2-oxazol-4-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid (3,5-dimethylisoxazol-4-yl)methyl ester Formula: C16H17NO5 MolecularWeight: 303.30988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=C(C(=NO1)C)COC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H17NO5/c1-10-13(11(2)22-17-10)9-21-16(18)12-4-5-14-15(8-12)20-7-3-6-19-14/h4-5,8H,3,6-7,9H2,1-2H3