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

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-phenoxyphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-[(2-phenoxyphenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-[(2-phenoxyphenyl)methyl]-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-phenoxyphenyl)methyl]carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-(2-phenoxybenzyl)carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C31H28N2O5 MolecularWeight: 508.56442

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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=C4OC5=CC=CC=C5)C(=O)N

Isomeric SMILES

CC(C)C(C(=O)O)OC1=CC=CC2=C1C3=C(C=CC=C3N2CC4=CC=CC=C4OC5=CC=CC=C5)C(=O)N

InChI

InChI=1S/C31H28N2O5/c1-19(2)29(31(35)36)38-26-17-9-15-24-28(26)27-22(30(32)34)13-8-14-23(27)33(24)18-20-10-6-7-16-25(20)37-21-11-4-3-5-12-21/h3-17,19,29H,18H2,1-2H3,(H2,32,34)(H,35,36)