(2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium

Systemtic Name: (2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium Openeye Name: (2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium CAS Name: (2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium IUPAC Name: (2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium Traditional Name: (2S)-2-[4-(3,5-dimethylphenoxy)phenyl]morpholin-4-ium Formula: C18H22NO2+ MolecularWeight: 284.37278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)C3C[NH2+]CCO3)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC2=CC=C(C=C2)[C@H]3C[NH2+]CCO3)C

InChI

InChI=1S/C18H21NO2/c1-13-9-14(2)11-17(10-13)21-16-5-3-15(4-6-16)18-12-19-7-8-20-18/h3-6,9-11,18-19H,7-8,12H2,1-2H3/p+1/t18-/m1/s1