ethyl 2-[[1,3-benzodioxol-5-ylmethyl(cycloheptylcarbonyl)amino]methyl]cyclopropane-1-carboxylate

Systemtic Name: ethyl 2-[[1,3-benzodioxol-5-ylmethyl(cycloheptylcarbonyl)amino]methyl]cyclopropane-1-carboxylate Openeye Name: ethyl 2-[[1,3-benzodioxol-5-ylmethyl(cycloheptanecarbonyl)amino]methyl]cyclopropanecarboxylate CAS Name: 2-[[1,3-benzodioxol-5-ylmethyl-[cycloheptyl(oxo)methyl]amino]methyl]-1-cyclopropanecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[1,3-benzodioxol-5-ylmethyl(cycloheptanecarbonyl)amino]methyl]cyclopropane-1-carboxylate Traditional Name: 2-[[cycloheptanecarbonyl(piperonyl)amino]methyl]cyclopropanecarboxylic acid ethyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC1CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4CCCCCC4

Isomeric SMILES

CCOC(=O)C1CC1CN(CC2=CC3=C(C=C2)OCO3)C(=O)C4CCCCCC4

InChI

InChI=1S/C23H31NO5/c1-2-27-23(26)19-12-18(19)14-24(22(25)17-7-5-3-4-6-8-17)13-16-9-10-20-21(11-16)29-15-28-20/h9-11,17-19H,2-8,12-15H2,1H3