methyl 4-[[(3R)-3-[(3-pyrazol-1-ylphenyl)carbamoyl]piperidin-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[(3R)-3-[(3-pyrazol-1-ylphenyl)carbamoyl]piperidin-1-yl]methyl]benzoate Openeye Name: methyl 4-[[(3R)-3-[(3-pyrazol-1-ylphenyl)carbamoyl]-1-piperidyl]methyl]benzoate CAS Name: 4-[[(3R)-3-[oxo-[3-(1-pyrazolyl)anilino]methyl]-1-piperidinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3R)-3-[(3-pyrazol-1-ylphenyl)carbamoyl]piperidin-1-yl]methyl]benzoate Traditional Name: 4-[[(3R)-3-[(3-pyrazol-1-ylphenyl)carbamoyl]piperidino]methyl]benzoic acid methyl ester Formula: C24H26N4O3 MolecularWeight: 418.48824

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2CCCC(C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2CCC[C@H](C2)C(=O)NC3=CC=CC(=C3)N4C=CC=N4

InChI

InChI=1S/C24H26N4O3/c1-31-24(30)19-10-8-18(9-11-19)16-27-13-3-5-20(17-27)23(29)26-21-6-2-7-22(15-21)28-14-4-12-25-28/h2,4,6-12,14-15,20H,3,5,13,16-17H2,1H3,(H,26,29)/t20-/m1/s1