2-[(5-butan-2-yl-3-butyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[(5-butan-2-yl-3-butyl-2-oxidanylidene-imidazol-1-yl)methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(3-butyl-2-oxo-5-sec-butyl-imidazol-1-yl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[(5-butan-2-yl-3-butyl-2-oxo-1-imidazolyl)methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(5-butan-2-yl-3-butyl-2-oxoimidazol-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(3-butyl-2-keto-5-sec-butyl-4-imidazolin-1-yl)methyl]-6-phenyl-benzoic acid Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(C)CC

Isomeric SMILES

CCCCN1C=C(N(C1=O)CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(C)CC

InChI

InChI=1S/C25H30N2O3/c1-4-6-15-26-17-22(18(3)5-2)27(25(26)30)16-20-13-10-14-21(23(20)24(28)29)19-11-8-7-9-12-19/h7-14,17-18H,4-6,15-16H2,1-3H3,(H,28,29)