(1S,2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-ol

Systemtic Name: (1S,2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-ol Openeye Name: (1S,2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-ol CAS Name: (1S,2S)-1-(4-butoxyphenyl)-3-(4-morpholin-4-iumyl)-2-phenyl-1-propanol IUPAC Name: (1S,2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenylpropan-1-ol Traditional Name: (1S,2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-ol Formula: C23H32NO3+ MolecularWeight: 370.50508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(C(C[NH+]2CCOCC2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@H]([C@H](C[NH+]2CCOCC2)C3=CC=CC=C3)O

InChI

InChI=1S/C23H31NO3/c1-2-3-15-27-21-11-9-20(10-12-21)23(25)22(19-7-5-4-6-8-19)18-24-13-16-26-17-14-24/h4-12,22-23,25H,2-3,13-18H2,1H3/p+1/t22-,23-/m1/s1