methyl 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)cyclohexane-1-carboxylate

Systemtic Name: methyl 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonylamino)cyclohexane-1-carboxylate Openeye Name: methyl 1-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)cyclohexanecarboxylate CAS Name: 1-[[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 1-(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonylamino)cyclohexane-1-carboxylate Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonylamino)cyclohexanecarboxylic acid methyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

COC(=O)C1(CCCCC1)NC(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C18H23NO5/c1-22-17(21)18(8-3-2-4-9-18)19-16(20)13-6-7-14-15(12-13)24-11-5-10-23-14/h6-7,12H,2-5,8-11H2,1H3,(H,19,20)