ethyl 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoate

Systemtic Name: ethyl 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoate Openeye Name: ethyl 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoate CAS Name: 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoate Traditional Name: 4-[(3,3-dimethyl-2,4-dihydro-1,5-benzodioxepin-7-yl)methoxy]benzoic acid ethyl ester Formula: C21H24O5 MolecularWeight: 356.41226

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)OCC(CO3)(C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OCC2=CC3=C(C=C2)OCC(CO3)(C)C

InChI

InChI=1S/C21H24O5/c1-4-23-20(22)16-6-8-17(9-7-16)24-12-15-5-10-18-19(11-15)26-14-21(2,3)13-25-18/h5-11H,4,12-14H2,1-3H3