1,3-benzodioxol-5-yl 1-(3,5-dimethoxyphenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: 1,3-benzodioxol-5-yl 1-(3,5-dimethoxyphenyl)carbonylpiperidine-4-carboxylate Openeye Name: 1,3-benzodioxol-5-yl 1-(3,5-dimethoxybenzoyl)piperidine-4-carboxylate CAS Name: 1-[(3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinecarboxylic acid 1,3-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl 1-(3,5-dimethoxybenzoyl)piperidine-4-carboxylate Traditional Name: 1-(3,5-dimethoxybenzoyl)isonipecotic acid 1,3-benzodioxol-5-yl ester Formula: C22H23NO7 MolecularWeight: 413.42052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)OC3=CC4=C(C=C3)OCO4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)C(=O)OC3=CC4=C(C=C3)OCO4)OC

InChI

InChI=1S/C22H23NO7/c1-26-17-9-15(10-18(11-17)27-2)21(24)23-7-5-14(6-8-23)22(25)30-16-3-4-19-20(12-16)29-13-28-19/h3-4,9-12,14H,5-8,13H2,1-2H3