methyl 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethyloxy)phenyl]methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate

Systemtic Name: methyl 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethyloxy)phenyl]methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate Openeye Name: methyl 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethoxy)phenyl]methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate CAS Name: 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethoxy)phenyl]methylamino]-2-pyrrolo[2,3-b]pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethoxy)phenyl]methylamino]pyrrolo[2,3-b]pyridine-2-carboxylate Traditional Name: 3-acetamido-1-ethyl-5-[[3-(2-hydroxyethoxy)benzyl]amino]pyrrolo[2,3-b]pyridine-2-carboxylic acid methyl ester Formula: C22H26N4O5 MolecularWeight: 426.46564

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C2=CC(=CN=C21)NCC3=CC(=CC=C3)OCCO)NC(=O)C)C(=O)OC

Isomeric SMILES

CCN1C(=C(C2=CC(=CN=C21)NCC3=CC(=CC=C3)OCCO)NC(=O)C)C(=O)OC

InChI

InChI=1S/C22H26N4O5/c1-4-26-20(22(29)30-3)19(25-14(2)28)18-11-16(13-24-21(18)26)23-12-15-6-5-7-17(10-15)31-9-8-27/h5-7,10-11,13,23,27H,4,8-9,12H2,1-3H3,(H,25,28)