N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-oxidanylidenepiperazin-1-ium-1-yl)ethanamide Openeye Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide CAS Name: N-[(2,4-dimethylanilino)-oxomethyl]-2-(3-oxo-1-piperazin-1-iumyl)acetamide IUPAC Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-oxopiperazin-1-ium-1-yl)acetamide Traditional Name: N-[(2,4-dimethylphenyl)carbamoyl]-2-(3-ketopiperazin-1-ium-1-yl)acetamide Formula: C15H21N4O3+ MolecularWeight: 305.35224

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH+]2CCNC(=O)C2)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)NC(=O)C[NH+]2CCNC(=O)C2)C

InChI

InChI=1S/C15H20N4O3/c1-10-3-4-12(11(2)7-10)17-15(22)18-14(21)9-19-6-5-16-13(20)8-19/h3-4,7H,5-6,8-9H2,1-2H3,(H,16,20)(H2,17,18,21,22)/p+1