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

Systemtic Name: 3-(5-chloranyl-1,3-benzoxazol-2-yl)-N-prop-2-enyl-pyridin-1-ium-2-amine Openeye Name: N-allyl-3-(5-chloro-1,3-benzoxazol-2-yl)pyridin-1-ium-2-amine CAS Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-prop-2-enyl-2-pyridin-1-iumamine IUPAC Name: 3-(5-chloro-1,3-benzoxazol-2-yl)-N-prop-2-enylpyridin-1-ium-2-amine Traditional Name: allyl-[3-(5-chloro-1,3-benzoxazol-2-yl)pyridin-1-ium-2-yl]amine Formula: C15H13ClN3O+ MolecularWeight: 286.73622

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC1=C(C=CC=[NH+]1)C2=NC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

C=CCNC1=C(C=CC=[NH+]1)C2=NC3=C(O2)C=CC(=C3)Cl

InChI

InChI=1S/C15H12ClN3O/c1-2-7-17-14-11(4-3-8-18-14)15-19-12-9-10(16)5-6-13(12)20-15/h2-6,8-9H,1,7H2,(H,17,18)/p+1