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

Systemtic Name: (3R,4R)-1-[[1-(3-methylphenyl)imidazol-2-yl]methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-4-morpholin-4-ium-4-yl-1-[[1-(m-tolyl)imidazol-2-yl]methyl]piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[[1-(3-methylphenyl)-2-imidazolyl]methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[[1-(3-methylphenyl)imidazol-2-yl]methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-4-morpholin-4-ium-4-yl-1-[[1-(m-tolyl)imidazol-2-yl]methyl]piperidin-1-ium-3-ol Formula: C20H30N4O2+2 MolecularWeight: 358.4778

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C=CN=C2C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

CC1=CC(=CC=C1)N2C=CN=C2C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C20H28N4O2/c1-16-3-2-4-17(13-16)24-8-6-21-20(24)15-22-7-5-18(19(25)14-22)23-9-11-26-12-10-23/h2-4,6,8,13,18-19,25H,5,7,9-12,14-15H2,1H3/p+2/t18-,19-/m1/s1