2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]propanoate

Systemtic Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]propanoate Openeye Name: 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]propanoate CAS Name: 3-[4-(4-fluorophenyl)-1-piperazinyl]propanoic acid 2-(2-methyl-5-nitro-1-imidazolyl)ethyl ester IUPAC Name: 2-(2-methyl-5-nitroimidazol-1-yl)ethyl 3-[4-(4-fluorophenyl)piperazin-1-yl]propanoate Traditional Name: 3-[4-(4-fluorophenyl)piperazino]propionic acid 2-(2-methyl-5-nitro-imidazol-1-yl)ethyl ester Formula: C19H24FN5O4 MolecularWeight: 405.423363

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C(N1CCOC(=O)CCN2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

Isomeric SMILES

CC1=NC=C(N1CCOC(=O)CCN2CCN(CC2)C3=CC=C(C=C3)F)[N+](=O)[O-]

InChI

InChI=1S/C19H24FN5O4/c1-15-21-14-18(25(27)28)24(15)12-13-29-19(26)6-7-22-8-10-23(11-9-22)17-4-2-16(20)3-5-17/h2-5,14H,6-13H2,1H3