butyl 4-[[1-(5-cyanopyridin-2-yl)piperidin-4-yl]carbonylamino]benzoate

Systemtic Name: butyl 4-[[1-(5-cyanopyridin-2-yl)piperidin-4-yl]carbonylamino]benzoate Openeye Name: butyl 4-[[1-(5-cyano-2-pyridyl)piperidine-4-carbonyl]amino]benzoate CAS Name: 4-[[[1-(5-cyano-2-pyridinyl)-4-piperidinyl]-oxomethyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[[1-(5-cyanopyridin-2-yl)piperidine-4-carbonyl]amino]benzoate Traditional Name: 4-[[1-(5-cyano-2-pyridyl)isonipecotoyl]amino]benzoic acid butyl ester Formula: C23H26N4O3 MolecularWeight: 406.47754

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)C3=NC=C(C=C3)C#N

InChI

InChI=1S/C23H26N4O3/c1-2-3-14-30-23(29)19-5-7-20(8-6-19)26-22(28)18-10-12-27(13-11-18)21-9-4-17(15-24)16-25-21/h4-9,16,18H,2-3,10-14H2,1H3,(H,26,28)