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

Systemtic Name: 2-[phenethyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,3-dicarboxylic acid Openeye Name: 2-[phenethyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,3-dicarboxylic acid CAS Name: 2-[oxo-[phenethyl-[(4-phenoxyphenyl)methyl]amino]methyl]cyclobutane-1,3-dicarboxylic acid IUPAC Name: 2-[phenethyl-[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,3-dicarboxylic acid Traditional Name: 2-[phenethyl-(4-phenoxybenzyl)carbamoyl]cyclobutane-1,3-dicarboxylic acid Formula: C28H27NO6 MolecularWeight: 473.51708

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(C(C1C(=O)O)C(=O)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)O

Isomeric SMILES

C1C(C(C1C(=O)O)C(=O)N(CCC2=CC=CC=C2)CC3=CC=C(C=C3)OC4=CC=CC=C4)C(=O)O

InChI

InChI=1S/C28H27NO6/c30-26(25-23(27(31)32)17-24(25)28(33)34)29(16-15-19-7-3-1-4-8-19)18-20-11-13-22(14-12-20)35-21-9-5-2-6-10-21/h1-14,23-25H,15-18H2,(H,31,32)(H,33,34)