2-[5-aminocarbonyl-9-[(2-phenylmethoxyphenyl)methyl]carbazol-4-yl]oxybutanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-phenylmethoxyphenyl)methyl]carbazol-4-yl]oxybutanoic acid Openeye Name: 2-[9-[(2-benzyloxyphenyl)methyl]-5-carbamoyl-carbazol-4-yl]oxybutanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2-phenylmethoxyphenyl)methyl]-4-carbazolyl]oxy]butanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-phenylmethoxyphenyl)methyl]carbazol-4-yl]oxybutanoic acid Traditional Name: 2-[9-(2-benzoxybenzyl)-5-carbamoyl-carbazol-4-yl]oxybutyric acid Formula: C31H28N2O5 MolecularWeight: 508.56442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4OCC5=CC=CC=C5)C(=O)N

Isomeric SMILES

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4OCC5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C31H28N2O5/c1-2-25(31(35)36)38-27-17-9-15-24-29(27)28-22(30(32)34)13-8-14-23(28)33(24)18-21-12-6-7-16-26(21)37-19-20-10-4-3-5-11-20/h3-17,25H,2,18-19H2,1H3,(H2,32,34)(H,35,36)