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

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2-cyanophenyl)methyl]-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-cyanophenyl)methyl]carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-(2-cyanobenzyl)carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C26H23N3O4 MolecularWeight: 441.47852

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4C#N)C(=O)N

Isomeric SMILES

CC(C)C(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4C#N)C(=O)N

InChI

InChI=1S/C26H23N3O4/c1-15(2)24(26(31)32)33-21-12-6-11-20-23(21)22-18(25(28)30)9-5-10-19(22)29(20)14-17-8-4-3-7-16(17)13-27/h3-12,15,24H,14H2,1-2H3,(H2,28,30)(H,31,32)