[3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-morpholin-4-ium-4-ylpiperidin-1-yl]methanone

Systemtic Name: [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-morpholin-4-ium-4-ylpiperidin-1-yl]methanone Openeye Name: [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-morpholin-4-ium-4-yl-1-piperidyl]methanone CAS Name: [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-(4-morpholin-4-iumyl)-1-piperidinyl]methanone IUPAC Name: [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-morpholin-4-ium-4-ylpiperidin-1-yl]methanone Traditional Name: [3-(2-methoxyphenyl)-1H-pyrazol-5-yl]-[(3S)-3-morpholin-4-ium-4-ylpiperidino]methanone Formula: C20H27N4O3+ MolecularWeight: 371.45338

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NNC(=C2)C(=O)N3CCCC(C3)[NH+]4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1C2=NNC(=C2)C(=O)N3CCC[C@@H](C3)[NH+]4CCOCC4

InChI

InChI=1S/C20H26N4O3/c1-26-19-7-3-2-6-16(19)17-13-18(22-21-17)20(25)24-8-4-5-15(14-24)23-9-11-27-12-10-23/h2-3,6-7,13,15H,4-5,8-12,14H2,1H3,(H,21,22)/p+1/t15-/m0/s1