N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-[2,6-bis(chloranyl)-3-methyl-phenyl]-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,6-dichloro-3-methyl-phenyl)acetamide CAS Name: 2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2,6-dichloro-3-methylphenyl)acetamide IUPAC Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,6-dichloro-3-methylphenyl)acetamide Traditional Name: 2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,6-dichloro-3-methyl-phenyl)acetamide Formula: C17H22Cl2N3O2+ MolecularWeight: 371.28148

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CC3)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)C[NH+]2CCN(CC2)C(=O)C3CC3)Cl

InChI

InChI=1S/C17H21Cl2N3O2/c1-11-2-5-13(18)16(15(11)19)20-14(23)10-21-6-8-22(9-7-21)17(24)12-3-4-12/h2,5,12H,3-4,6-10H2,1H3,(H,20,23)/p+1