(E)-3-[2-butyl-5-chloranyl-3-[(4-nitrophenyl)methyl]imidazol-4-yl]prop-1-en-1-ol

Systemtic Name: (E)-3-[2-butyl-5-chloranyl-3-[(4-nitrophenyl)methyl]imidazol-4-yl]prop-1-en-1-ol Openeye Name: (E)-3-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]prop-1-en-1-ol CAS Name: (E)-3-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]-4-imidazolyl]-1-propen-1-ol IUPAC Name: (E)-3-[2-butyl-5-chloro-3-[(4-nitrophenyl)methyl]imidazol-4-yl]prop-1-en-1-ol Traditional Name: (E)-3-[2-butyl-5-chloro-3-(4-nitrobenzyl)imidazol-4-yl]prop-1-en-1-ol Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])CC=CO)Cl

Isomeric SMILES

CCCCC1=NC(=C(N1CC2=CC=C(C=C2)[N+](=O)[O-])C/C=C/O)Cl

InChI

InChI=1S/C17H20ClN3O3/c1-2-3-6-16-19-17(18)15(5-4-11-22)20(16)12-13-7-9-14(10-8-13)21(23)24/h4,7-11,22H,2-3,5-6,12H2,1H3/b11-4+