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

Systemtic Name: [(S)-(3-iodanylphenyl)-(2-oxidanylidene-1,3-dihydrobenzimidazol-5-yl)methyl]azanium Openeye Name: [(S)-(3-iodophenyl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium CAS Name: [(S)-(3-iodophenyl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium IUPAC Name: [(S)-(3-iodophenyl)-(2-oxo-1,3-dihydrobenzimidazol-5-yl)methyl]azanium Traditional Name: [(S)-(3-iodophenyl)-(2-keto-1,3-dihydrobenzimidazol-5-yl)methyl]ammonium Formula: C14H13IN3O+ MolecularWeight: 366.17699

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12IN3O/c15-10-3-1-2-8(6-10)13(16)9-4-5-11-12(7-9)18-14(19)17-11/h1-7,13H,16H2,(H2,17,18,19)/p+1/t13-/m1/s1