1-[(2R)-2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]carbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone

Systemtic Name: 1-[(2R)-2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-yl]carbonyl-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Openeye Name: 1-[(2R)-2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-carbonyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone CAS Name: 1-[(2R)-2-[[2-(cyclohexylamino)-4-methyl-1-pyridin-1-iumyl]-oxomethyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone IUPAC Name: 1-[(2R)-2-[2-(cyclohexylamino)-4-methylpyridin-1-ium-1-carbonyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Traditional Name: 1-[(2R)-2-[2-(cyclohexylamino)-4-methyl-pyridin-1-ium-1-carbonyl]-2,3-dihydro-1,4-benzoxazin-4-yl]ethanone Formula: C23H28N3O3+ MolecularWeight: 394.48672

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[N+](C=C1)C(=O)C2CN(C3=CC=CC=C3O2)C(=O)C)NC4CCCCC4

Isomeric SMILES

CC1=CC(=[N+](C=C1)C(=O)[C@H]2CN(C3=CC=CC=C3O2)C(=O)C)NC4CCCCC4

InChI

InChI=1S/C23H27N3O3/c1-16-12-13-25(22(14-16)24-18-8-4-3-5-9-18)23(28)21-15-26(17(2)27)19-10-6-7-11-20(19)29-21/h6-7,10-14,18,21H,3-5,8-9,15H2,1-2H3/p+1/t21-/m1/s1