(3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxo-ethyl]piperazin-4-ium-2-one CAS Name: (3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-keto-ethyl]piperazin-4-ium-2-one Formula: C15H20N3O2+ MolecularWeight: 274.3382

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=CC=CC=C2N(C1)C(=O)CC3C(=O)NCC[NH2+]3

Isomeric SMILES

C1CC2=CC=CC=C2N(C1)C(=O)C[C@@H]3C(=O)NCC[NH2+]3

InChI

InChI=1S/C15H19N3O2/c19-14(10-12-15(20)17-8-7-16-12)18-9-3-5-11-4-1-2-6-13(11)18/h1-2,4,6,12,16H,3,5,7-10H2,(H,17,20)/p+1/t12-/m1/s1