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

Systemtic Name: (3R,4R)-1-[(2-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Openeye Name: (3R,4R)-1-[[2-(cyclopentoxy)phenyl]methyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol CAS Name: (3R,4R)-1-[(2-cyclopentyloxyphenyl)methyl]-4-(4-morpholin-4-iumyl)-3-piperidin-1-iumol IUPAC Name: (3R,4R)-1-[(2-cyclopentyloxyphenyl)methyl]-4-morpholin-4-ium-4-ylpiperidin-1-ium-3-ol Traditional Name: (3R,4R)-1-[2-(cyclopentoxy)benzyl]-4-morpholin-4-ium-4-yl-piperidin-1-ium-3-ol Formula: C21H34N2O3+2 MolecularWeight: 362.50626

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=CC=C2C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(C1)OC2=CC=CC=C2C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C21H32N2O3/c24-20-16-22(10-9-19(20)23-11-13-25-14-12-23)15-17-5-1-4-8-21(17)26-18-6-2-3-7-18/h1,4-5,8,18-20,24H,2-3,6-7,9-16H2/p+2/t19-,20-/m1/s1