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

Systemtic Name: 2-[5-aminocarbonyl-9-[(3,5-dimethylphenyl)methyl]carbazol-4-yl]oxybutanoic acid Openeye Name: 2-[5-carbamoyl-9-[(3,5-dimethylphenyl)methyl]carbazol-4-yl]oxybutanoic acid CAS Name: 2-[[5-carbamoyl-9-[(3,5-dimethylphenyl)methyl]-4-carbazolyl]oxy]butanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(3,5-dimethylphenyl)methyl]carbazol-4-yl]oxybutanoic acid Traditional Name: 2-[5-carbamoyl-9-(3,5-dimethylbenzyl)carbazol-4-yl]oxybutyric acid Formula: C26H26N2O4 MolecularWeight: 430.49564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N2O4/c1-4-21(26(30)31)32-22-10-6-9-20-24(22)23-18(25(27)29)7-5-8-19(23)28(20)14-17-12-15(2)11-16(3)13-17/h5-13,21H,4,14H2,1-3H3,(H2,27,29)(H,30,31)