4-[[2-butyl-5-[(Z)-3-oxidanyl-3-oxidanylidene-2-(selenophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid

Systemtic Name: 4-[[2-butyl-5-[(Z)-3-oxidanyl-3-oxidanylidene-2-(selenophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid Openeye Name: 4-[[2-butyl-5-[(Z)-3-hydroxy-3-oxo-2-(selenophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid CAS Name: 4-[[2-butyl-5-[(Z)-3-hydroxy-3-oxo-2-(2-selenophenylmethyl)prop-1-enyl]-1-imidazolyl]methyl]benzoic acid IUPAC Name: 4-[[2-butyl-5-[(Z)-3-hydroxy-3-oxo-2-(selenophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid Traditional Name: 4-[[2-butyl-5-[(Z)-3-hydroxy-3-keto-2-(selenophen-2-ylmethyl)prop-1-enyl]imidazol-1-yl]methyl]benzoic acid Formula: C23H24N2O4Se MolecularWeight: 471.40766

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)O)C=C(CC3=CC=C[Se]3)C(=O)O

Isomeric SMILES

CCCCC1=NC=C(N1CC2=CC=C(C=C2)C(=O)O)/C=C(/CC3=CC=C[Se]3)\C(=O)O

InChI

InChI=1S/C23H24N2O4Se/c1-2-3-6-21-24-14-19(12-18(23(28)29)13-20-5-4-11-30-20)25(21)15-16-7-9-17(10-8-16)22(26)27/h4-5,7-12,14H,2-3,6,13,15H2,1H3,(H,26,27)(H,28,29)/b18-12-