(3R,4R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-morpholino-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[[1-(2-methoxyphenyl)-4-pyrazolyl]methyl]-4-(4-morpholinyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-morpholin-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[[1-(2-methoxyphenyl)pyrazol-4-yl]methyl]-4-morpholino-piperidin-1-ium-3-ol Formula: C20H29N4O3+ MolecularWeight: 373.46926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C=C(C=N2)C[NH+]3CCC(C(C3)O)N4CCOCC4

Isomeric SMILES

COC1=CC=CC=C1N2C=C(C=N2)C[NH+]3CC[C@H]([C@@H](C3)O)N4CCOCC4

InChI

InChI=1S/C20H28N4O3/c1-26-20-5-3-2-4-18(20)24-14-16(12-21-24)13-22-7-6-17(19(25)15-22)23-8-10-27-11-9-23/h2-5,12,14,17,19,25H,6-11,13,15H2,1H3/p+1/t17-,19-/m1/s1