ethyl 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]butanoate

Systemtic Name: ethyl 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]butanoate Openeye Name: ethyl 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]butanoate CAS Name: 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1-pyrazolyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]butanoate Traditional Name: 3-methyl-3-[4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-1-yl]butyric acid ethyl ester Formula: C17H20N4O2 MolecularWeight: 312.3663

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)(C)N1C=C(C=N1)C2=C3C=CNC3=NC=C2

Isomeric SMILES

CCOC(=O)CC(C)(C)N1C=C(C=N1)C2=C3C=CNC3=NC=C2

InChI

InChI=1S/C17H20N4O2/c1-4-23-15(22)9-17(2,3)21-11-12(10-20-21)13-5-7-18-16-14(13)6-8-19-16/h5-8,10-11H,4,9H2,1-3H3,(H,18,19)