(1-butylpiperidin-4-yl)methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate

Systemtic Name: (1-butylpiperidin-4-yl)methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate Openeye Name: (1-butyl-4-piperidyl)methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate CAS Name: 1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (1-butyl-4-piperidinyl)methyl ester IUPAC Name: (1-butylpiperidin-4-yl)methyl 1H-pyrrolo[2,3-b]pyridine-3-carboxylate Traditional Name: 1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid (1-butyl-4-piperidyl)methyl ester Formula: C18H25N3O2 MolecularWeight: 315.41

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCC(CC1)COC(=O)C2=CNC3=C2C=CC=N3

Isomeric SMILES

CCCCN1CCC(CC1)COC(=O)C2=CNC3=C2C=CC=N3

InChI

InChI=1S/C18H25N3O2/c1-2-3-9-21-10-6-14(7-11-21)13-23-18(22)16-12-20-17-15(16)5-4-8-19-17/h4-5,8,12,14H,2-3,6-7,9-11,13H2,1H3,(H,19,20)