(2S)-4-(1H-imidazol-2-ylmethyl)-2-[(3-methoxyphenyl)methyl]morpholin-4-ium

Systemtic Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2-[(3-methoxyphenyl)methyl]morpholin-4-ium Openeye Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2-[(3-methoxyphenyl)methyl]morpholin-4-ium CAS Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2-[(3-methoxyphenyl)methyl]morpholin-4-ium IUPAC Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2-[(3-methoxyphenyl)methyl]morpholin-4-ium Traditional Name: (2S)-4-(1H-imidazol-2-ylmethyl)-2-m-anisyl-morpholin-4-ium Formula: C16H22N3O2+ MolecularWeight: 288.36478

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2C[NH+](CCO2)CC3=NC=CN3

Isomeric SMILES

COC1=CC=CC(=C1)C[C@H]2C[NH+](CCO2)CC3=NC=CN3

InChI

InChI=1S/C16H21N3O2/c1-20-14-4-2-3-13(9-14)10-15-11-19(7-8-21-15)12-16-17-5-6-18-16/h2-6,9,15H,7-8,10-12H2,1H3,(H,17,18)/p+1/t15-/m0/s1