[3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]phenyl]methylazanium

Systemtic Name: [3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]phenyl]methylazanium Openeye Name: [3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxo-ethoxy]phenyl]methylammonium CAS Name: [3,5-dimethyl-4-[2-(4-methyl-1-piperazinyl)-2-oxoethoxy]phenyl]methylammonium IUPAC Name: [3,5-dimethyl-4-[2-(4-methylpiperazin-1-yl)-2-oxoethoxy]phenyl]methylazanium Traditional Name: [4-[2-keto-2-(4-methylpiperazino)ethoxy]-3,5-dimethyl-benzyl]ammonium Formula: C16H26N3O2+ MolecularWeight: 292.39654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1OCC(=O)N2CCN(CC2)C)C)C[NH3+]

Isomeric SMILES

CC1=CC(=CC(=C1OCC(=O)N2CCN(CC2)C)C)C[NH3+]

InChI

InChI=1S/C16H25N3O2/c1-12-8-14(10-17)9-13(2)16(12)21-11-15(20)19-6-4-18(3)5-7-19/h8-9H,4-7,10-11,17H2,1-3H3/p+1