3,4-bis[(4-fluorophenyl)methyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid

Systemtic Name: 3,4-bis[(4-fluorophenyl)methyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid Openeye Name: 3,4-bis[(4-fluorophenyl)methyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid CAS Name: 3,4-bis[[(4-fluorophenyl)methyl-[(4-phenoxyphenyl)methyl]amino]-oxomethyl]cyclobutane-1,2-dicarboxylic acid IUPAC Name: 3,4-bis[(4-fluorophenyl)methyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid Traditional Name: 3,4-bis[(4-fluorobenzyl)-(4-phenoxybenzyl)carbamoyl]cyclobutane-1,2-dicarboxylic acid Formula: C48H40F2N2O8 MolecularWeight: 810.836606

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)CN(CC3=CC=C(C=C3)F)C(=O)C4C(C(C4C(=O)O)C(=O)O)C(=O)N(CC5=CC=C(C=C5)OC6=CC=CC=C6)CC7=CC=C(C=C7)F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)CN(CC3=CC=C(C=C3)F)C(=O)C4C(C(C4C(=O)O)C(=O)O)C(=O)N(CC5=CC=C(C=C5)OC6=CC=CC=C6)CC7=CC=C(C=C7)F

InChI

InChI=1S/C48H40F2N2O8/c49-35-19-11-31(12-20-35)27-51(29-33-15-23-39(24-16-33)59-37-7-3-1-4-8-37)45(53)41-42(44(48(57)58)43(41)47(55)56)46(54)52(28-32-13-21-36(50)22-14-32)30-34-17-25-40(26-18-34)60-38-9-5-2-6-10-38/h1-26,41-44H,27-30H2,(H,55,56)(H,57,58)