4-[carboxymethyl-[3-(4-phenoxyphenyl)-5-phenyl-pentan-2-yl]carbamoyl]cyclohexane-1,1-dicarboxylic acid

Systemtic Name: 4-[carboxymethyl-[3-(4-phenoxyphenyl)-5-phenyl-pentan-2-yl]carbamoyl]cyclohexane-1,1-dicarboxylic acid Openeye Name: 4-[carboxymethyl-[1-methyl-2-(4-phenoxyphenyl)-4-phenyl-butyl]carbamoyl]cyclohexane-1,1-dicarboxylic acid CAS Name: 4-[[carboxymethyl-[3-(4-phenoxyphenyl)-5-phenylpentan-2-yl]amino]-oxomethyl]cyclohexane-1,1-dicarboxylic acid IUPAC Name: 4-[carboxymethyl-[3-(4-phenoxyphenyl)-5-phenylpentan-2-yl]carbamoyl]cyclohexane-1,1-dicarboxylic acid Traditional Name: 4-[carboxymethyl-[1-methyl-2-(4-phenoxyphenyl)-4-phenyl-butyl]carbamoyl]cyclohexane-1,1-dicarboxylic acid Formula: C34H37NO8 MolecularWeight: 587.65948

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(CCC1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=CC=C3)N(CC(=O)O)C(=O)C4CCC(CC4)(C(=O)O)C(=O)O

Isomeric SMILES

CC(C(CCC1=CC=CC=C1)C2=CC=C(C=C2)OC3=CC=CC=C3)N(CC(=O)O)C(=O)C4CCC(CC4)(C(=O)O)C(=O)O

InChI

InChI=1S/C34H37NO8/c1-23(35(22-30(36)37)31(38)26-18-20-34(21-19-26,32(39)40)33(41)42)29(17-12-24-8-4-2-5-9-24)25-13-15-28(16-14-25)43-27-10-6-3-7-11-27/h2-11,13-16,23,26,29H,12,17-22H2,1H3,(H,36,37)(H,39,40)(H,41,42)