3-[4-[2-[ethyl(phenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]propylazanium

Systemtic Name: 3-[4-[2-[ethyl(phenyl)amino]-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]propylazanium Openeye Name: 3-[4-[2-(N-ethylanilino)-2-oxo-ethyl]piperazin-4-ium-1-yl]propylammonium CAS Name: 3-[4-[2-(N-ethylanilino)-2-oxoethyl]-1-piperazin-4-iumyl]propylammonium IUPAC Name: 3-[4-[2-(N-ethylanilino)-2-oxoethyl]piperazin-4-ium-1-yl]propylazanium Traditional Name: 3-[4-[2-(N-ethylanilino)-2-keto-ethyl]piperazin-4-ium-1-yl]propylammonium Formula: C17H30N4O+2 MolecularWeight: 306.4463

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=CC=C1)C(=O)C[NH+]2CCN(CC2)CCC[NH3+]

Isomeric SMILES

CCN(C1=CC=CC=C1)C(=O)C[NH+]2CCN(CC2)CCC[NH3+]

InChI

InChI=1S/C17H28N4O/c1-2-21(16-7-4-3-5-8-16)17(22)15-20-13-11-19(12-14-20)10-6-9-18/h3-5,7-8H,2,6,9-15,18H2,1H3/p+2