[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium

Systemtic Name: [(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-[(2R)-1-oxidanylbutan-2-yl]azanium Openeye Name: [(1R)-1-(hydroxymethyl)propyl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]ammonium CAS Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-[4-(1-imidazolyl)phenyl]ethyl]ammonium IUPAC Name: [(2R)-1-hydroxybutan-2-yl]-[(1R)-1-(4-imidazol-1-ylphenyl)ethyl]azanium Traditional Name: [(1R)-1-(4-imidazol-1-ylphenyl)ethyl]-[(1R)-1-methylolpropyl]ammonium Formula: C15H22N3O+ MolecularWeight: 260.35468

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CO)[NH2+]C(C)C1=CC=C(C=C1)N2C=CN=C2

Isomeric SMILES

CC[C@H](CO)[NH2+][C@H](C)C1=CC=C(C=C1)N2C=CN=C2

InChI

InChI=1S/C15H21N3O/c1-3-14(10-19)17-12(2)13-4-6-15(7-5-13)18-9-8-16-11-18/h4-9,11-12,14,17,19H,3,10H2,1-2H3/p+1/t12-,14-/m1/s1