(3R,4R)-1-[(3-chloranyl-4-ethoxy-phenyl)methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol

Systemtic Name: (3R,4R)-1-[(3-chloranyl-4-ethoxy-phenyl)methyl]-4-morpholin-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[(3-chloro-4-ethoxy-phenyl)methyl]-4-morpholino-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(3-chloro-4-ethoxyphenyl)methyl]-4-(4-morpholinyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(3-chloro-4-ethoxyphenyl)methyl]-4-morpholin-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-(3-chloro-4-ethoxy-benzyl)-4-morpholino-piperidin-1-ium-3-ol Formula: C18H28ClN2O3+ MolecularWeight: 355.87952

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C[NH+]2CCC(C(C2)O)N3CCOCC3)Cl

Isomeric SMILES

CCOC1=C(C=C(C=C1)C[NH+]2CC[C@H]([C@@H](C2)O)N3CCOCC3)Cl

InChI

InChI=1S/C18H27ClN2O3/c1-2-24-18-4-3-14(11-15(18)19)12-20-6-5-16(17(22)13-20)21-7-9-23-10-8-21/h3-4,11,16-17,22H,2,5-10,12-13H2,1H3/p+1/t16-,17-/m1/s1