methyl 2-chloranyl-4-[4-[[(6-pyrazol-1-ylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]carbonyl-benzoate

Systemtic Name: methyl 2-chloranyl-4-[4-[[(6-pyrazol-1-ylpyridin-2-yl)methylamino]methyl]piperidin-1-yl]carbonyl-benzoate Openeye Name: methyl 2-chloro-4-[4-[[(6-pyrazol-1-yl-2-pyridyl)methylamino]methyl]piperidine-1-carbonyl]benzoate CAS Name: 2-chloro-4-[oxo-[4-[[[6-(1-pyrazolyl)-2-pyridinyl]methylamino]methyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 2-chloro-4-[4-[[(6-pyrazol-1-ylpyridin-2-yl)methylamino]methyl]piperidine-1-carbonyl]benzoate Traditional Name: 2-chloro-4-[4-[[(6-pyrazol-1-yl-2-pyridyl)methylamino]methyl]piperidine-1-carbonyl]benzoic acid methyl ester Formula: C24H26ClN5O3 MolecularWeight: 467.94794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=C(C=C1)C(=O)N2CCC(CC2)CNCC3=NC(=CC=C3)N4C=CC=N4)Cl

Isomeric SMILES

COC(=O)C1=C(C=C(C=C1)C(=O)N2CCC(CC2)CNCC3=NC(=CC=C3)N4C=CC=N4)Cl

InChI

InChI=1S/C24H26ClN5O3/c1-33-24(32)20-7-6-18(14-21(20)25)23(31)29-12-8-17(9-13-29)15-26-16-19-4-2-5-22(28-19)30-11-3-10-27-30/h2-7,10-11,14,17,26H,8-9,12-13,15-16H2,1H3