2-[4-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-4-ium-1-yl]ethylazanium

Systemtic Name: 2-[4-[2-oxidanylidene-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-4-ium-1-yl]ethylazanium Openeye Name: 2-[4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-4-ium-1-yl]ethylammonium CAS Name: 2-[4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]-1-piperazin-4-iumyl]ethylammonium IUPAC Name: 2-[4-[2-oxo-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-4-ium-1-yl]ethylazanium Traditional Name: 2-[4-[2-keto-2-[[(1S)-1-phenylethyl]amino]ethyl]piperazin-4-ium-1-yl]ethylammonium Formula: C16H28N4O+2 MolecularWeight: 292.41972

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H](C1=CC=CC=C1)NC(=O)C[NH+]2CCN(CC2)CC[NH3+]

InChI

InChI=1S/C16H26N4O/c1-14(15-5-3-2-4-6-15)18-16(21)13-20-11-9-19(8-7-17)10-12-20/h2-6,14H,7-13,17H2,1H3,(H,18,21)/p+2/t14-/m0/s1