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

Systemtic Name: (3-methyl-1,2-oxazol-5-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Openeye Name: (3-methylisoxazol-5-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate CAS Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid (3-methyl-5-isoxazolyl)methyl ester IUPAC Name: (3-methyl-1,2-oxazol-5-yl)methyl 3,4-dihydro-2H-1,5-benzodioxepine-7-carboxylate Traditional Name: 3,4-dihydro-2H-1,5-benzodioxepin-7-carboxylic acid (3-methylisoxazol-5-yl)methyl ester Formula: C15H15NO5 MolecularWeight: 289.2833

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1)COC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC1=NOC(=C1)COC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C15H15NO5/c1-10-7-12(21-16-10)9-20-15(17)11-3-4-13-14(8-11)19-6-2-5-18-13/h3-4,7-8H,2,5-6,9H2,1H3