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

Systemtic Name: ethyl 6-[(1,3-benzodioxol-5-ylmethylamino)methyl]-4-(4-methoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: ethyl 6-[(1,3-benzodioxol-5-ylmethylamino)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: 6-[(1,3-benzodioxol-5-ylmethylamino)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester IUPAC Name: ethyl 6-[(1,3-benzodioxol-5-ylmethylamino)methyl]-4-(4-methoxyphenyl)-2-oxo-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: 2-keto-4-(4-methoxyphenyl)-6-[(piperonylamino)methyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid ethyl ester Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CNCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C2=CC=C(C=C2)OC)CNCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H25N3O6/c1-3-30-22(27)20-17(12-24-11-14-4-9-18-19(10-14)32-13-31-18)25-23(28)26-21(20)15-5-7-16(29-2)8-6-15/h4-10,21,24H,3,11-13H2,1-2H3,(H2,25,26,28)