methyl 5-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Systemtic Name: methyl 5-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylate Openeye Name: methyl 5-[4-(morpholinomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylate CAS Name: 5-[4-(4-morpholinylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 5-[4-(morpholin-4-ylmethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylate Traditional Name: 5-[4-(morpholinomethyl)phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid methyl ester Formula: C20H21N3O3 MolecularWeight: 351.39904

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC2=NC=C(C=C12)C3=CC=C(C=C3)CN4CCOCC4

Isomeric SMILES

COC(=O)C1=CNC2=NC=C(C=C12)C3=CC=C(C=C3)CN4CCOCC4

InChI

InChI=1S/C20H21N3O3/c1-25-20(24)18-12-22-19-17(18)10-16(11-21-19)15-4-2-14(3-5-15)13-23-6-8-26-9-7-23/h2-5,10-12H,6-9,13H2,1H3,(H,21,22)