1-(2-chloranyl-4-nitro-imidazol-1-yl)-2-methyl-3-[4-[(E)-3-phenylprop-2-enoxy]piperidin-1-yl]propan-2-ol

Systemtic Name: 1-(2-chloranyl-4-nitro-imidazol-1-yl)-2-methyl-3-[4-[(E)-3-phenylprop-2-enoxy]piperidin-1-yl]propan-2-ol Openeye Name: 1-(2-chloro-4-nitro-imidazol-1-yl)-3-[4-[(E)-cinnamyl]oxy-1-piperidyl]-2-methyl-propan-2-ol CAS Name: 1-(2-chloro-4-nitro-1-imidazolyl)-2-methyl-3-[4-[(E)-3-phenylprop-2-enoxy]-1-piperidinyl]-2-propanol IUPAC Name: 1-(2-chloro-4-nitroimidazol-1-yl)-2-methyl-3-[4-[(E)-3-phenylprop-2-enoxy]piperidin-1-yl]propan-2-ol Traditional Name: 1-(2-chloro-4-nitro-imidazol-1-yl)-3-[4-[(E)-cinnamyl]oxypiperidino]-2-methyl-propan-2-ol Formula: C21H27ClN4O4 MolecularWeight: 434.91648

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCC(CC1)OCC=CC2=CC=CC=C2)(CN3C=C(N=C3Cl)[N+](=O)[O-])O

Isomeric SMILES

CC(CN1CCC(CC1)OC/C=C/C2=CC=CC=C2)(CN3C=C(N=C3Cl)[N+](=O)[O-])O

InChI

InChI=1S/C21H27ClN4O4/c1-21(27,16-25-14-19(26(28)29)23-20(25)22)15-24-11-9-18(10-12-24)30-13-5-8-17-6-3-2-4-7-17/h2-8,14,18,27H,9-13,15-16H2,1H3/b8-5+