2-methyl-2-phenyl-1-piperazin-4-ium-1-yl-propan-1-one

Systemtic Name: 2-methyl-2-phenyl-1-piperazin-4-ium-1-yl-propan-1-one Openeye Name: 2-methyl-2-phenyl-1-piperazin-4-ium-1-yl-propan-1-one CAS Name: 2-methyl-2-phenyl-1-(1-piperazin-4-iumyl)-1-propanone IUPAC Name: 2-methyl-2-phenyl-1-piperazin-4-ium-1-ylpropan-1-one Traditional Name: 2-methyl-2-phenyl-1-piperazin-4-ium-1-yl-propan-1-one Formula: C14H21N2O+ MolecularWeight: 233.32934

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CC[NH2+]CC2

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CC[NH2+]CC2

InChI

InChI=1S/C14H20N2O/c1-14(2,12-6-4-3-5-7-12)13(17)16-10-8-15-9-11-16/h3-7,15H,8-11H2,1-2H3/p+1