methyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethyl]piperidine-4-carboxylate CAS Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]piperidine-4-carboxylate Traditional Name: 1-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethyl]isonipecotic acid methyl ester Formula: C16H20N2O5 MolecularWeight: 320.3404

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)OCO3

Isomeric SMILES

COC(=O)C1CCN(CC1)CC(=O)NC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H20N2O5/c1-21-16(20)11-4-6-18(7-5-11)9-15(19)17-12-2-3-13-14(8-12)23-10-22-13/h2-3,8,11H,4-7,9-10H2,1H3,(H,17,19)