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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)OC2=CC=C(C=C2)C[NH+]3CCC(C(C3)O)[NH+]4CCOCC4

Isomeric SMILES

C1CCC(C1)OC2=CC=C(C=C2)C[NH+]3CC[C@H]([C@@H](C3)O)[NH+]4CCOCC4

InChI

InChI=1S/C21H32N2O3/c24-21-16-22(10-9-20(21)23-11-13-25-14-12-23)15-17-5-7-19(8-6-17)26-18-3-1-2-4-18/h5-8,18,20-21,24H,1-4,9-16H2/p+2/t20-,21-/m1/s1