2-[5-aminocarbonyl-9-[(3-bromophenyl)methyl]-2-pentyl-carbazol-4-yl]oxyethanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-bromophenyl)methyl]-2-pentyl-carbazol-4-yl]oxyethanoic acid Openeye Name: 2-[9-[(3-bromophenyl)methyl]-5-carbamoyl-2-pentyl-carbazol-4-yl]oxyacetic acid CAS Name: 2-[[9-[(3-bromophenyl)methyl]-5-carbamoyl-2-pentyl-4-carbazolyl]oxy]acetic acid IUPAC Name: 2-[9-[(3-bromophenyl)methyl]-5-carbamoyl-2-pentylcarbazol-4-yl]oxyacetic acid Traditional Name: 2-[2-amyl-9-(3-bromobenzyl)-5-carbamoyl-carbazol-4-yl]oxyacetic acid Formula: C27H27BrN2O4 MolecularWeight: 523.41828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC2=C(C(=C1)OCC(=O)O)C3=C(C=CC=C3N2CC4=CC(=CC=C4)Br)C(=O)N

Isomeric SMILES

CCCCCC1=CC2=C(C(=C1)OCC(=O)O)C3=C(C=CC=C3N2CC4=CC(=CC=C4)Br)C(=O)N

InChI

InChI=1S/C27H27BrN2O4/c1-2-3-4-7-17-13-22-26(23(14-17)34-16-24(31)32)25-20(27(29)33)10-6-11-21(25)30(22)15-18-8-5-9-19(28)12-18/h5-6,8-14H,2-4,7,15-16H2,1H3,(H2,29,33)(H,31,32)