(2S)-2-[(3-methoxyphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)morpholin-4-ium

Systemtic Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)morpholin-4-ium Openeye Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)morpholin-4-ium CAS Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-[3-(1-pyrazolyl)propyl]morpholin-4-ium IUPAC Name: (2S)-2-[(3-methoxyphenyl)methyl]-4-(3-pyrazol-1-ylpropyl)morpholin-4-ium Traditional Name: (2S)-2-m-anisyl-4-(3-pyrazol-1-ylpropyl)morpholin-4-ium Formula: C18H26N3O2+ MolecularWeight: 316.41794

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CC2C[NH+](CCO2)CCCN3C=CC=N3

Isomeric SMILES

COC1=CC=CC(=C1)C[C@H]2C[NH+](CCO2)CCCN3C=CC=N3

InChI

InChI=1S/C18H25N3O2/c1-22-17-6-2-5-16(13-17)14-18-15-20(11-12-23-18)8-4-10-21-9-3-7-19-21/h2-3,5-7,9,13,18H,4,8,10-12,14-15H2,1H3/p+1/t18-/m0/s1