2-[5-aminocarbonyl-9-[(3-cyanophenyl)methyl]carbazol-4-yl]oxyheptanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-cyanophenyl)methyl]carbazol-4-yl]oxyheptanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3-cyanophenyl)methyl]carbazol-4-yl]oxyheptanoic acid CAS Name: 2-[[5-carbamoyl-9-[(3-cyanophenyl)methyl]-4-carbazolyl]oxy]heptanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(3-cyanophenyl)methyl]carbazol-4-yl]oxyheptanoic acid Traditional Name: 2-[5-carbamoyl-9-(3-cyanobenzyl)carbazol-4-yl]oxyenanthic acid Formula: C28H27N3O4 MolecularWeight: 469.53168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC(=C4)C#N)C(=O)N

Isomeric SMILES

CCCCCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC(=C4)C#N)C(=O)N

InChI

InChI=1S/C28H27N3O4/c1-2-3-4-13-24(28(33)34)35-23-14-7-12-22-26(23)25-20(27(30)32)10-6-11-21(25)31(22)17-19-9-5-8-18(15-19)16-29/h5-12,14-15,24H,2-4,13,17H2,1H3,(H2,30,32)(H,33,34)