methyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-4-yl-ethyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[(1S)-2-oxidanylidene-2-piperazin-1-yl-1-pyridin-4-yl-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[(1S)-2-oxo-2-piperazin-1-yl-1-(4-pyridyl)ethyl]ammonium CAS Name: methyl-[(1S)-2-oxo-2-(1-piperazinyl)-1-pyridin-4-ylethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[(1S)-2-oxo-2-piperazin-1-yl-1-pyridin-4-ylethyl]azanium Traditional Name: benzyl-[(1S)-2-keto-2-piperazino-1-(4-pyridyl)ethyl]-methyl-ammonium Formula: C19H25N4O+ MolecularWeight: 325.428

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)C(C2=CC=NC=C2)C(=O)N3CCNCC3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)[C@@H](C2=CC=NC=C2)C(=O)N3CCNCC3

InChI

InChI=1S/C19H24N4O/c1-22(15-16-5-3-2-4-6-16)18(17-7-9-20-10-8-17)19(24)23-13-11-21-12-14-23/h2-10,18,21H,11-15H2,1H3/p+1/t18-/m0/s1