6-methyl-2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzoxazole

Systemtic Name: 6-methyl-2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzoxazole Openeye Name: 6-methyl-2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzoxazole CAS Name: 6-methyl-2-[4-(1-pyridin-1-iumylmethyl)phenyl]-1,3-benzoxazole IUPAC Name: 6-methyl-2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzoxazole Traditional Name: 6-methyl-2-[4-(pyridin-1-ium-1-ylmethyl)phenyl]-1,3-benzoxazole Formula: C20H17N2O+ MolecularWeight: 301.36178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(O2)C3=CC=C(C=C3)C[N+]4=CC=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(O2)C3=CC=C(C=C3)C[N+]4=CC=CC=C4

InChI

InChI=1S/C20H17N2O/c1-15-5-10-18-19(13-15)23-20(21-18)17-8-6-16(7-9-17)14-22-11-3-2-4-12-22/h2-13H,14H2,1H3/q+1