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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(C2=CC3=C(C=C2)NC(=O)N3)[NH3+]

Isomeric SMILES

CCOC1=CC=C(C=C1)[C@@H](C2=CC3=C(C=C2)NC(=O)N3)[NH3+]

InChI

InChI=1S/C16H17N3O2/c1-2-21-12-6-3-10(4-7-12)15(17)11-5-8-13-14(9-11)19-16(20)18-13/h3-9,15H,2,17H2,1H3,(H2,18,19,20)/p+1/t15-/m0/s1