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

Systemtic Name: (2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-one Openeye Name: (2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-one CAS Name: (2S)-1-(4-butoxyphenyl)-3-(4-morpholin-4-iumyl)-2-phenyl-1-propanone IUPAC Name: (2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenylpropan-1-one Traditional Name: (2S)-1-(4-butoxyphenyl)-3-morpholin-4-ium-4-yl-2-phenyl-propan-1-one Formula: C23H30NO3+ MolecularWeight: 368.4892

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H29NO3/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/h4-12,22H,2-3,13-18H2,1H3/p+1/t22-/m1/s1