ethyl 4-[3-(1,3-benzodioxol-5-ylcarbonyl)piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[3-(1,3-benzodioxol-5-ylcarbonyl)piperidin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[3-(1,3-benzodioxole-5-carbonyl)-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[3-[1,3-benzodioxol-5-yl(oxo)methyl]-1-piperidinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[3-(1,3-benzodioxole-5-carbonyl)piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-(3-piperonyloylpiperidino)piperidine-1-carboxylic acid ethyl ester Formula: C21H28N2O5 MolecularWeight: 388.45742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCCC(C2)C(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H28N2O5/c1-2-26-21(25)22-10-7-17(8-11-22)23-9-3-4-16(13-23)20(24)15-5-6-18-19(12-15)28-14-27-18/h5-6,12,16-17H,2-4,7-11,13-14H2,1H3