[(2S)-1-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium

Systemtic Name: [(2S)-1-[[4-(4-methylpiperazin-4-ium-1-yl)phenyl]amino]-1-oxidanylidene-propan-2-yl]azanium Openeye Name: [(1S)-1-methyl-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-2-oxo-ethyl]ammonium CAS Name: [(2S)-1-[4-(4-methyl-1-piperazin-4-iumyl)anilino]-1-oxopropan-2-yl]ammonium IUPAC Name: [(2S)-1-[4-(4-methylpiperazin-4-ium-1-yl)anilino]-1-oxopropan-2-yl]azanium Traditional Name: [(1S)-2-keto-1-methyl-2-[4-(4-methylpiperazin-4-ium-1-yl)anilino]ethyl]ammonium Formula: C14H24N4O+2 MolecularWeight: 264.36656

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)N2CC[NH+](CC2)C)[NH3+]

Isomeric SMILES

C[C@@H](C(=O)NC1=CC=C(C=C1)N2CC[NH+](CC2)C)[NH3+]

InChI

InChI=1S/C14H22N4O/c1-11(15)14(19)16-12-3-5-13(6-4-12)18-9-7-17(2)8-10-18/h3-6,11H,7-10,15H2,1-2H3,(H,16,19)/p+2/t11-/m0/s1