3-[2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one

Systemtic Name: 3-[2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]-2-oxidanylidene-ethyl]-1,3-benzoxazol-2-one Openeye Name: 3-[2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]-2-oxo-ethyl]-1,3-benzoxazol-2-one CAS Name: 3-[2-[2-(cyclohexylamino)-1-pyridin-1-iumyl]-2-oxoethyl]-1,3-benzoxazol-2-one IUPAC Name: 3-[2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]-2-oxoethyl]-1,3-benzoxazol-2-one Traditional Name: 3-[2-[2-(cyclohexylamino)pyridin-1-ium-1-yl]-2-keto-ethyl]-1,3-benzoxazol-2-one Formula: C20H22N3O3+ MolecularWeight: 352.40698

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=CC=CC=[N+]2C(=O)CN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1CCC(CC1)NC2=CC=CC=[N+]2C(=O)CN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H21N3O3/c24-19(14-23-16-10-4-5-11-17(16)26-20(23)25)22-13-7-6-12-18(22)21-15-8-2-1-3-9-15/h4-7,10-13,15H,1-3,8-9,14H2/p+1