2-[5-aminocarbonyl-9-[(2,6-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid

Systemtic Name: 2-[5-aminocarbonyl-9-[(2,6-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-[(2,6-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2,6-dimethylphenyl)methyl]-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2,6-dimethylphenyl)methyl]carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-(2,6-dimethylbenzyl)carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C27H28N2O4 MolecularWeight: 444.52222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N

Isomeric SMILES

CC1=C(C(=CC=C1)C)CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N

InChI

InChI=1S/C27H28N2O4/c1-15(2)25(27(31)32)33-22-13-7-12-21-24(22)23-18(26(28)30)10-6-11-20(23)29(21)14-19-16(3)8-5-9-17(19)4/h5-13,15,25H,14H2,1-4H3,(H2,28,30)(H,31,32)