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

Systemtic Name: (3R,4R)-1-[(2-methoxyquinolin-3-yl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(2-methoxy-3-quinolyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(2-methoxy-3-quinolinyl)methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(2-methoxyquinolin-3-yl)methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[(2-methoxy-3-quinolyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Formula: C20H29N3O3+2 MolecularWeight: 359.46256

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NC2=CC=CC=C2C=C1C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

COC1=NC2=CC=CC=C2C=C1C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C20H27N3O3/c1-25-20-16(12-15-4-2-3-5-17(15)21-20)13-22-7-6-18(19(24)14-22)23-8-10-26-11-9-23/h2-5,12,18-19,24H,6-11,13-14H2,1H3/p+2/t18-,19-/m1/s1