pyridin-4-ylmethyl 3-(1,3-benzodioxol-5-yl)-4-methyl-9-oxidanylidene-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylate

Systemtic Name: pyridin-4-ylmethyl 3-(1,3-benzodioxol-5-yl)-4-methyl-9-oxidanylidene-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylate Openeye Name: 4-pyridylmethyl 3-(1,3-benzodioxol-5-yl)-4-methyl-9-oxo-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylate CAS Name: 3-(1,3-benzodioxol-5-yl)-4-methyl-9-oxo-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl 3-(1,3-benzodioxol-5-yl)-4-methyl-9-oxo-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylate Traditional Name: 3-(1,3-benzodioxol-5-yl)-9-keto-4-methyl-1,3-dihydropyrrolo[3,4-b]quinoline-2-carboxylic acid 4-pyridylmethyl ester Formula: C26H21N3O5 MolecularWeight: 455.46204

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=O)C3=C1C(N(C3)C(=O)OCC4=CC=NC=C4)C5=CC6=C(C=C5)OCO6

Isomeric SMILES

CN1C2=CC=CC=C2C(=O)C3=C1C(N(C3)C(=O)OCC4=CC=NC=C4)C5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H21N3O5/c1-28-20-5-3-2-4-18(20)25(30)19-13-29(26(31)32-14-16-8-10-27-11-9-16)23(24(19)28)17-6-7-21-22(12-17)34-15-33-21/h2-12,23H,13-15H2,1H3