[4-[(1R)-1-(3-nitrophenyl)ethyl]piperazin-4-ium-1-yl]-phenyl-methanone

Systemtic Name: [4-[(1R)-1-(3-nitrophenyl)ethyl]piperazin-4-ium-1-yl]-phenyl-methanone Openeye Name: [4-[(1R)-1-(3-nitrophenyl)ethyl]piperazin-4-ium-1-yl]-phenyl-methanone CAS Name: [4-[(1R)-1-(3-nitrophenyl)ethyl]-1-piperazin-4-iumyl]-phenylmethanone IUPAC Name: [4-[(1R)-1-(3-nitrophenyl)ethyl]piperazin-4-ium-1-yl]-phenylmethanone Traditional Name: [4-[(1R)-1-(3-nitrophenyl)ethyl]piperazin-4-ium-1-yl]-phenyl-methanone Formula: C19H22N3O3+ MolecularWeight: 340.39628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

Isomeric SMILES

C[C@H](C1=CC(=CC=C1)[N+](=O)[O-])[NH+]2CCN(CC2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O3/c1-15(17-8-5-9-18(14-17)22(24)25)20-10-12-21(13-11-20)19(23)16-6-3-2-4-7-16/h2-9,14-15H,10-13H2,1H3/p+1/t15-/m1/s1