ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethanoyl]amino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxidanylidene-ethanoyl]amino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxo-acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-1,2-dioxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(1,3-benzodioxol-5-ylmethylamino)-2-oxoacetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-keto-2-(piperonylamino)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H23N3O6 MolecularWeight: 377.39172

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C18H23N3O6/c1-2-25-18(24)21-7-5-13(6-8-21)20-17(23)16(22)19-10-12-3-4-14-15(9-12)27-11-26-14/h3-4,9,13H,2,5-8,10-11H2,1H3,(H,19,22)(H,20,23)