[(1S)-2-(4-methoxyphenyl)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium

Systemtic Name: [(1S)-2-(4-methoxyphenyl)-1-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium Openeye Name: [(1S)-2-(4-methoxyphenyl)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]ammonium CAS Name: [(1S)-2-(4-methoxyphenyl)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]ammonium IUPAC Name: [(1S)-2-(4-methoxyphenyl)-1-(2-oxo-1,3-dihydrobenzimidazol-5-yl)ethyl]azanium Traditional Name: [(1S)-1-(2-keto-1,3-dihydrobenzimidazol-5-yl)-2-(4-methoxyphenyl)ethyl]ammonium Formula: C16H18N3O2+ MolecularWeight: 284.33302

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C2=CC3=C(C=C2)NC(=O)N3)[NH3+]

Isomeric SMILES

COC1=CC=C(C=C1)C[C@@H](C2=CC3=C(C=C2)NC(=O)N3)[NH3+]

InChI

InChI=1S/C16H17N3O2/c1-21-12-5-2-10(3-6-12)8-13(17)11-4-7-14-15(9-11)19-16(20)18-14/h2-7,9,13H,8,17H2,1H3,(H2,18,19,20)/p+1/t13-/m0/s1