tert-butyl 4-(piperidin-4-ylcarbonylamino)pyrrolo[2,3-b]pyridine-1-carboxylate

Systemtic Name: tert-butyl 4-(piperidin-4-ylcarbonylamino)pyrrolo[2,3-b]pyridine-1-carboxylate Openeye Name: tert-butyl 4-(piperidine-4-carbonylamino)pyrrolo[2,3-b]pyridine-1-carboxylate CAS Name: 4-[[oxo(4-piperidinyl)methyl]amino]-1-pyrrolo[2,3-b]pyridinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(piperidine-4-carbonylamino)pyrrolo[2,3-b]pyridine-1-carboxylate Traditional Name: 4-(isonipecotoylamino)pyrrolo[2,3-b]pyridine-1-carboxylic acid tert-butyl ester Formula: C18H24N4O3 MolecularWeight: 344.40816

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1C=CC2=C(C=CN=C21)NC(=O)C3CCNCC3

Isomeric SMILES

CC(C)(C)OC(=O)N1C=CC2=C(C=CN=C21)NC(=O)C3CCNCC3

InChI

InChI=1S/C18H24N4O3/c1-18(2,3)25-17(24)22-11-7-13-14(6-10-20-15(13)22)21-16(23)12-4-8-19-9-5-12/h6-7,10-12,19H,4-5,8-9H2,1-3H3,(H,20,21,23)