4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium

Systemtic Name: 4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium Openeye Name: 4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium CAS Name: 4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium IUPAC Name: 4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium Traditional Name: 4-[(E)-4-(3,5-dimethylphenoxy)but-2-enyl]morpholin-4-ium Formula: C16H24NO2+ MolecularWeight: 262.36726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC=CC[NH+]2CCOCC2)C

Isomeric SMILES

CC1=CC(=CC(=C1)OC/C=C/C[NH+]2CCOCC2)C

InChI

InChI=1S/C16H23NO2/c1-14-11-15(2)13-16(12-14)19-8-4-3-5-17-6-9-18-10-7-17/h3-4,11-13H,5-10H2,1-2H3/p+1/b4-3+