(2S)-1-morpholin-4-ium-4-yl-3-(4-propan-2-ylphenoxy)propan-2-ol

Systemtic Name: (2S)-1-morpholin-4-ium-4-yl-3-(4-propan-2-ylphenoxy)propan-2-ol Openeye Name: (2S)-1-(4-isopropylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol CAS Name: (2S)-1-(4-morpholin-4-iumyl)-3-(4-propan-2-ylphenoxy)-2-propanol IUPAC Name: (2S)-1-morpholin-4-ium-4-yl-3-(4-propan-2-ylphenoxy)propan-2-ol Traditional Name: (2S)-1-(4-isopropylphenoxy)-3-morpholin-4-ium-4-yl-propan-2-ol Formula: C16H26NO3+ MolecularWeight: 280.38254

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)OCC(C[NH+]2CCOCC2)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)OC[C@H](C[NH+]2CCOCC2)O

InChI

InChI=1S/C16H25NO3/c1-13(2)14-3-5-16(6-4-14)20-12-15(18)11-17-7-9-19-10-8-17/h3-6,13,15,18H,7-12H2,1-2H3/p+1/t15-/m0/s1