ethyl 2-[[butyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonyl)amino]methyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl 2-[[butyl(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbonyl)amino]methyl]cyclopropane-1-carboxylate Openeye Name: ethyl 2-[[butyl(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)amino]methyl]cyclopropanecarboxylate CAS Name: 2-[[butyl-[3,4-dihydro-2H-1,5-benzodioxepin-7-yl(oxo)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[butyl(3,4-dihydro-2H-1,5-benzodioxepine-7-carbonyl)amino]methyl]cyclopropane-1-carboxylate Traditional Name: 2-[[butyl(3,4-dihydro-2H-1,5-benzodioxepin-7-carbonyl)amino]methyl]cyclopropanecarboxylic acid ethyl ester Formula: C21H29NO5 MolecularWeight: 375.45866

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1CC1C(=O)OCC)C(=O)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCCCN(CC1CC1C(=O)OCC)C(=O)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C21H29NO5/c1-3-5-9-22(14-16-12-17(16)21(24)25-4-2)20(23)15-7-8-18-19(13-15)27-11-6-10-26-18/h7-8,13,16-17H,3-6,9-12,14H2,1-2H3