3-(1-methylpyrazol-4-yl)-1-[3-(4-phenoxyphenyl)carbonylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-(1-methylpyrazol-4-yl)-1-[3-(4-phenoxyphenyl)carbonylpiperidin-1-yl]propan-1-one Openeye Name: 3-(1-methylpyrazol-4-yl)-1-[3-(4-phenoxybenzoyl)-1-piperidyl]propan-1-one CAS Name: 3-(1-methyl-4-pyrazolyl)-1-[3-[oxo-(4-phenoxyphenyl)methyl]-1-piperidinyl]-1-propanone IUPAC Name: 3-(1-methylpyrazol-4-yl)-1-[3-(4-phenoxybenzoyl)piperidin-1-yl]propan-1-one Traditional Name: 3-(1-methylpyrazol-4-yl)-1-[3-(4-phenoxybenzoyl)piperidino]propan-1-one Formula: C25H27N3O3 MolecularWeight: 417.50018

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=N1)CCC(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

CN1C=C(C=N1)CCC(=O)N2CCCC(C2)C(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C25H27N3O3/c1-27-17-19(16-26-27)9-14-24(29)28-15-5-6-21(18-28)25(30)20-10-12-23(13-11-20)31-22-7-3-2-4-8-22/h2-4,7-8,10-13,16-17,21H,5-6,9,14-15,18H2,1H3