[3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone

Systemtic Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Openeye Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(1-piperidyl)-1-piperidyl]methanone CAS Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-[4-(1-piperidinyl)-1-piperidinyl]methanone IUPAC Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-(4-piperidin-1-ylpiperidin-1-yl)methanone Traditional Name: [3-(3-methoxyphenyl)-1H-pyrazol-5-yl]-(4-piperidinopiperidino)methanone Formula: C21H28N4O2 MolecularWeight: 368.47262

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCC(CC3)N4CCCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C2=NNC(=C2)C(=O)N3CCC(CC3)N4CCCCC4

InChI

InChI=1S/C21H28N4O2/c1-27-18-7-5-6-16(14-18)19-15-20(23-22-19)21(26)25-12-8-17(9-13-25)24-10-3-2-4-11-24/h5-7,14-15,17H,2-4,8-13H2,1H3,(H,22,23)