N-(2,6-dimethylphenyl)-2-[4-[(2-oxidanylidene-1H-quinolin-3-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[(2-oxidanylidene-1H-quinolin-3-yl)carbonyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-1H-quinoline-3-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[oxo-(2-oxo-1H-quinolin-3-yl)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-(2-oxo-1H-quinoline-3-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-(2-keto-1H-quinoline-3-carbonyl)piperazin-1-ium-1-yl]acetamide Formula: C24H27N4O3+ MolecularWeight: 419.49618

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC4=CC=CC=C4NC3=O

InChI

InChI=1S/C24H26N4O3/c1-16-6-5-7-17(2)22(16)26-21(29)15-27-10-12-28(13-11-27)24(31)19-14-18-8-3-4-9-20(18)25-23(19)30/h3-9,14H,10-13,15H2,1-2H3,(H,25,30)(H,26,29)/p+1