ethyl 6-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: ethyl 6-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-4-ethyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[[1,3-benzodioxol-5-ylmethyl(ethyl)amino]methyl]-4-ethyl-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 4-ethyl-6-[[ethyl(piperonyl)amino]methyl]-2-keto-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C20H27N3O5 MolecularWeight: 389.44548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1C(=C(NC(=O)N1)CN(CC)CC2=CC3=C(C=C2)OCO3)C(=O)OCC

Isomeric SMILES

CCC1C(=C(NC(=O)N1)CN(CC)CC2=CC3=C(C=C2)OCO3)C(=O)OCC

InChI

InChI=1S/C20H27N3O5/c1-4-14-18(19(24)26-6-3)15(22-20(25)21-14)11-23(5-2)10-13-7-8-16-17(9-13)28-12-27-16/h7-9,14H,4-6,10-12H2,1-3H3,(H2,21,22,25)