2-[5-aminocarbonyl-9-[(3-chloranyl-4-methyl-phenyl)methyl]carbazol-4-yl]oxybutanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(3-chloranyl-4-methyl-phenyl)methyl]carbazol-4-yl]oxybutanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3-chloro-4-methyl-phenyl)methyl]carbazol-4-yl]oxybutanoic acid CAS Name: 2-[[5-carbamoyl-9-[(3-chloro-4-methylphenyl)methyl]-4-carbazolyl]oxy]butanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(3-chloro-4-methylphenyl)methyl]carbazol-4-yl]oxybutanoic acid Traditional Name: 2-[5-carbamoyl-9-(3-chloro-4-methyl-benzyl)carbazol-4-yl]oxybutyric acid Formula: C25H23ClN2O4 MolecularWeight: 450.91412

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC(=C(C=C4)C)Cl)C(=O)N

Isomeric SMILES

CCC(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC(=C(C=C4)C)Cl)C(=O)N

InChI

InChI=1S/C25H23ClN2O4/c1-3-20(25(30)31)32-21-9-5-8-19-23(21)22-16(24(27)29)6-4-7-18(22)28(19)13-15-11-10-14(2)17(26)12-15/h4-12,20H,3,13H2,1-2H3,(H2,27,29)(H,30,31)