methyl 4-[[4-[5-(cyclopentylcarbonylamino)pyrazol-1-yl]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[4-[5-(cyclopentylcarbonylamino)pyrazol-1-yl]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[4-[5-(cyclopentanecarbonylamino)pyrazol-1-yl]-1-piperidyl]methyl]benzoate CAS Name: 4-[[4-[5-[[cyclopentyl(oxo)methyl]amino]-1-pyrazolyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[5-(cyclopentanecarbonylamino)pyrazol-1-yl]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[4-[5-(cyclopentanecarbonylamino)pyrazol-1-yl]piperidino]methyl]benzoic acid methyl ester Formula: C23H30N4O3 MolecularWeight: 410.5093

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)N3C(=CC=N3)NC(=O)C4CCCC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC(CC2)N3C(=CC=N3)NC(=O)C4CCCC4

InChI

InChI=1S/C23H30N4O3/c1-30-23(29)19-8-6-17(7-9-19)16-26-14-11-20(12-15-26)27-21(10-13-24-27)25-22(28)18-4-2-3-5-18/h6-10,13,18,20H,2-5,11-12,14-16H2,1H3,(H,25,28)