(2R)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: (2R)-2-(6-methyl-2-nitro-pyridin-3-yl)oxy-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: (2R)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: (2R)-2-[(6-methyl-2-nitro-3-pyridinyl)oxy]-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: (2R)-2-(6-methyl-2-nitropyridin-3-yl)oxy-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: (2R)-2-[(6-methyl-2-nitro-3-pyridyl)oxy]-1-(4-phenylpiperazino)propan-1-one Formula: C19H22N4O4 MolecularWeight: 370.40238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C=C1)OC(C)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=NC(=C(C=C1)O[C@H](C)C(=O)N2CCN(CC2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c1-14-8-9-17(18(20-14)23(25)26)27-15(2)19(24)22-12-10-21(11-13-22)16-6-4-3-5-7-16/h3-9,15H,10-13H2,1-2H3/t15-/m1/s1