(4-iodophenyl)-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium

Systemtic Name: (4-iodophenyl)-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethyl]azanium Openeye Name: (4-iodophenyl)-[2-(4-methylpiperazin-1-yl)-2-oxo-ethyl]ammonium CAS Name: (4-iodophenyl)-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]ammonium IUPAC Name: (4-iodophenyl)-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]azanium Traditional Name: (4-iodophenyl)-[2-keto-2-(4-methylpiperazino)ethyl]ammonium Formula: C13H19IN3O+ MolecularWeight: 360.21393

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)C[NH2+]C2=CC=C(C=C2)I

Isomeric SMILES

CN1CCN(CC1)C(=O)C[NH2+]C2=CC=C(C=C2)I

InChI

InChI=1S/C13H18IN3O/c1-16-6-8-17(9-7-16)13(18)10-15-12-4-2-11(14)3-5-12/h2-5,15H,6-10H2,1H3/p+1