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

Systemtic Name: 2-[5-aminocarbonyl-9-[(2-methyl-6-naphthalen-2-yl-phenyl)methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid Openeye Name: 2-[5-carbamoyl-9-[[2-methyl-6-(2-naphthyl)phenyl]methyl]carbazol-4-yl]oxy-3-methyl-butanoic acid CAS Name: 2-[[5-carbamoyl-9-[[2-methyl-6-(2-naphthalenyl)phenyl]methyl]-4-carbazolyl]oxy]-3-methylbutanoic acid IUPAC Name: 2-[5-carbamoyl-9-[(2-methyl-6-naphthalen-2-ylphenyl)methyl]carbazol-4-yl]oxy-3-methylbutanoic acid Traditional Name: 2-[5-carbamoyl-9-[2-methyl-6-(2-naphthyl)benzyl]carbazol-4-yl]oxy-3-methyl-butyric acid Formula: C36H32N2O4 MolecularWeight: 556.65028

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N)C5=CC6=CC=CC=C6C=C5

Isomeric SMILES

CC1=CC=CC(=C1CN2C3=C(C(=CC=C3)OC(C(C)C)C(=O)O)C4=C(C=CC=C42)C(=O)N)C5=CC6=CC=CC=C6C=C5

InChI

InChI=1S/C36H32N2O4/c1-21(2)34(36(40)41)42-31-16-8-15-30-33(31)32-27(35(37)39)13-7-14-29(32)38(30)20-28-22(3)9-6-12-26(28)25-18-17-23-10-4-5-11-24(23)19-25/h4-19,21,34H,20H2,1-3H3,(H2,37,39)(H,40,41)