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

Systemtic Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(furan-2-ylcarbonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-[(2,3-dimethylanilino)-oxomethyl]-2-[4-[2-furanyl(oxo)methyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(furan-2-carbonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: N-[(2,3-dimethylphenyl)carbamoyl]-2-[4-(2-furoyl)piperazin-1-ium-1-yl]acetamide Formula: C20H25N4O4+ MolecularWeight: 385.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C(=O)C3=CC=CO3)C

InChI

InChI=1S/C20H24N4O4/c1-14-5-3-6-16(15(14)2)21-20(27)22-18(25)13-23-8-10-24(11-9-23)19(26)17-7-4-12-28-17/h3-7,12H,8-11,13H2,1-2H3,(H2,21,22,25,27)/p+1