3-(5-chloranyl-1,3-benzoxazol-2-yl)-N-methyl-pyridin-1-ium-2-amine

Systemtic Name: 3-(5-chloranyl-1,3-benzoxazol-2-yl)-N-methyl-pyridin-1-ium-2-amine Openeye Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-methyl-pyridin-1-ium-2-amine CAS Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-methyl-2-pyridin-1-iumamine IUPAC Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-methylpyridin-1-ium-2-amine Traditional Name: [3-(5-chloro-1,3-benzoxazol-2-yl)pyridin-1-ium-2-yl]-methyl-amine Formula: C13H11ClN3O+ MolecularWeight: 260.69894

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=CC=[NH+]1)C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CNC1=C(C=CC=[NH+]1)C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C13H10ClN3O/c1-15-12-9(3-2-6-16-12)13-17-10-7-8(14)4-5-11(10)18-13/h2-7H,1H3,(H,15,16)/p+1