ethyl 4-(4-methoxycarbonylphenyl)-2-methyl-7-(2-methylpropyl)-5-oxidanylidene-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylate

Systemtic Name: ethyl 4-(4-methoxycarbonylphenyl)-2-methyl-7-(2-methylpropyl)-5-oxidanylidene-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 7-isobutyl-4-(4-methoxycarbonylphenyl)-2-methyl-5-oxo-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylate CAS Name: 4-(4-methoxycarbonylphenyl)-2-methyl-7-(2-methylpropyl)-5-oxo-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-methoxycarbonylphenyl)-2-methyl-7-(2-methylpropyl)-5-oxo-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-(4-carbomethoxyphenyl)-7-isobutyl-5-keto-2-methyl-6,7-dihydropyrrolo[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C23H26N2O5 MolecularWeight: 410.46294

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2C(NC(=O)C2=C1C3=CC=C(C=C3)C(=O)OC)CC(C)C)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2C(NC(=O)C2=C1C3=CC=C(C=C3)C(=O)OC)CC(C)C)C

InChI

InChI=1S/C23H26N2O5/c1-6-30-23(28)17-13(4)24-20-16(11-12(2)3)25-21(26)19(20)18(17)14-7-9-15(10-8-14)22(27)29-5/h7-10,12,16H,6,11H2,1-5H3,(H,25,26)