1,3-benzodioxol-5-ylmethyl (4S)-6-methyl-2-oxidanylidene-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate

Systemtic Name: 1,3-benzodioxol-5-ylmethyl (4S)-6-methyl-2-oxidanylidene-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Openeye Name: 1,3-benzodioxol-5-ylmethyl (4S)-6-methyl-2-oxo-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate CAS Name: (4S)-6-methyl-2-oxo-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid 1,3-benzodioxol-5-ylmethyl ester IUPAC Name: 1,3-benzodioxol-5-ylmethyl (4S)-6-methyl-2-oxo-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylate Traditional Name: (4S)-2-keto-6-methyl-4-(2-propoxyphenyl)-3,4-dihydro-1H-pyrimidine-5-carboxylic acid piperonyl ester Formula: C23H24N2O6 MolecularWeight: 424.44646

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2C(=C(NC(=O)N2)C)C(=O)OCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCCOC1=CC=CC=C1[C@H]2C(=C(NC(=O)N2)C)C(=O)OCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H24N2O6/c1-3-10-28-17-7-5-4-6-16(17)21-20(14(2)24-23(27)25-21)22(26)29-12-15-8-9-18-19(11-15)31-13-30-18/h4-9,11,21H,3,10,12-13H2,1-2H3,(H2,24,25,27)/t21-/m0/s1