5-[[5-[2-(1-adamantyl)ethyl]-2-naphthalen-2-yl-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-[[5-[2-(1-adamantyl)ethyl]-2-naphthalen-2-yl-1H-imidazol-4-yl]carbonylamino]benzene-1,3-dicarboxylic acid Openeye Name: 5-[[5-[2-(1-adamantyl)ethyl]-2-(2-naphthyl)-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid CAS Name: 5-[[[5-[2-(1-adamantyl)ethyl]-2-(2-naphthalenyl)-1H-imidazol-4-yl]-oxomethyl]amino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-[[5-[2-(1-adamantyl)ethyl]-2-naphthalen-2-yl-1H-imidazole-4-carbonyl]amino]benzene-1,3-dicarboxylic acid Traditional Name: 5-[[5-[2-(1-adamantyl)ethyl]-2-(2-naphthyl)-1H-imidazole-4-carbonyl]amino]isophthalic acid Formula: C34H33N3O5 MolecularWeight: 563.64292

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC6=CC=CC=C6C=C5)C(=O)NC7=CC(=CC(=C7)C(=O)O)C(=O)O

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CCC4=C(N=C(N4)C5=CC6=CC=CC=C6C=C5)C(=O)NC7=CC(=CC(=C7)C(=O)O)C(=O)O

InChI

InChI=1S/C34H33N3O5/c38-31(35-27-14-25(32(39)40)13-26(15-27)33(41)42)29-28(7-8-34-16-19-9-20(17-34)11-21(10-19)18-34)36-30(37-29)24-6-5-22-3-1-2-4-23(22)12-24/h1-6,12-15,19-21H,7-11,16-18H2,(H,35,38)(H,36,37)(H,39,40)(H,41,42)