3,5-bis(3-methylbutyl)-2-oxidanylidene-1-[(2-phenylphenyl)methyl]imidazole-4-carboxylic acid

Systemtic Name: 3,5-bis(3-methylbutyl)-2-oxidanylidene-1-[(2-phenylphenyl)methyl]imidazole-4-carboxylic acid Openeye Name: 3,5-diisopentyl-2-oxo-1-[(2-phenylphenyl)methyl]imidazole-4-carboxylic acid CAS Name: 3,5-bis(3-methylbutyl)-2-oxo-1-[(2-phenylphenyl)methyl]-4-imidazolecarboxylic acid IUPAC Name: 3,5-bis(3-methylbutyl)-2-oxo-1-[(2-phenylphenyl)methyl]imidazole-4-carboxylic acid Traditional Name: 3,5-diisoamyl-2-keto-1-(2-phenylbenzyl)-4-imidazoline-4-carboxylic acid Formula: C27H34N2O3 MolecularWeight: 434.57046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC1=C(N(C(=O)N1CC2=CC=CC=C2C3=CC=CC=C3)CCC(C)C)C(=O)O

Isomeric SMILES

CC(C)CCC1=C(N(C(=O)N1CC2=CC=CC=C2C3=CC=CC=C3)CCC(C)C)C(=O)O

InChI

InChI=1S/C27H34N2O3/c1-19(2)14-15-24-25(26(30)31)28(17-16-20(3)4)27(32)29(24)18-22-12-8-9-13-23(22)21-10-6-5-7-11-21/h5-13,19-20H,14-18H2,1-4H3,(H,30,31)