3-imidazol-1-ylpropyl-[(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(1S)-1-(5-methoxy-2-oxidanyl-phenyl)ethyl]azanium Openeye Name: [(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium CAS Name: [(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]-[3-(1-imidazolyl)propyl]ammonium IUPAC Name: [(1S)-1-(2-hydroxy-5-methoxyphenyl)ethyl]-(3-imidazol-1-ylpropyl)azanium Traditional Name: [(1S)-1-(2-hydroxy-5-methoxy-phenyl)ethyl]-(3-imidazol-1-ylpropyl)ammonium Formula: C15H22N3O2+ MolecularWeight: 276.35408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=CC(=C1)OC)O)[NH2+]CCCN2C=CN=C2

Isomeric SMILES

C[C@@H](C1=C(C=CC(=C1)OC)O)[NH2+]CCCN2C=CN=C2

InChI

InChI=1S/C15H21N3O2/c1-12(14-10-13(20-2)4-5-15(14)19)17-6-3-8-18-9-7-16-11-18/h4-5,7,9-12,17,19H,3,6,8H2,1-2H3/p+1/t12-/m0/s1