methyl 2-[(1-phenyl-5-piperidin-4-yl-pyrazol-4-yl)carbonylamino]benzoate

Systemtic Name: methyl 2-[(1-phenyl-5-piperidin-4-yl-pyrazol-4-yl)carbonylamino]benzoate Openeye Name: methyl 2-[[1-phenyl-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoate CAS Name: 2-[[oxo-[1-phenyl-5-(4-piperidinyl)-4-pyrazolyl]methyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[(1-phenyl-5-piperidin-4-ylpyrazole-4-carbonyl)amino]benzoate Traditional Name: 2-[[1-phenyl-5-(4-piperidyl)pyrazole-4-carbonyl]amino]benzoic acid methyl ester Formula: C23H24N4O3 MolecularWeight: 404.46166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCNCC4

Isomeric SMILES

COC(=O)C1=CC=CC=C1NC(=O)C2=C(N(N=C2)C3=CC=CC=C3)C4CCNCC4

InChI

InChI=1S/C23H24N4O3/c1-30-23(29)18-9-5-6-10-20(18)26-22(28)19-15-25-27(17-7-3-2-4-8-17)21(19)16-11-13-24-14-12-16/h2-10,15-16,24H,11-14H2,1H3,(H,26,28)