(1,3-benzodioxol-5-ylmethylamino) 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate

Systemtic Name: (1,3-benzodioxol-5-ylmethylamino) 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate Openeye Name: (1,3-benzodioxol-5-ylmethylamino) 2-(2-methylindolin-1-yl)pyrimidine-5-carboxylate CAS Name: 2-(2-methyl-2,3-dihydroindol-1-yl)-5-pyrimidinecarboxylic acid (1,3-benzodioxol-5-ylmethylamino) ester IUPAC Name: (1,3-benzodioxol-5-ylmethylamino) 2-(2-methyl-2,3-dihydroindol-1-yl)pyrimidine-5-carboxylate Traditional Name: 2-(2-methylindolin-1-yl)pyrimidine-5-carboxylic acid (piperonylamino) ester Formula: C22H20N4O4 MolecularWeight: 404.4186

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)ONCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1CC2=CC=CC=C2N1C3=NC=C(C=N3)C(=O)ONCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H20N4O4/c1-14-8-16-4-2-3-5-18(16)26(14)22-23-11-17(12-24-22)21(27)30-25-10-15-6-7-19-20(9-15)29-13-28-19/h2-7,9,11-12,14,25H,8,10,13H2,1H3