5-tert-butyl-2-[naphthalen-1-yl(phenyl)amino]benzene-1,3-dicarboxylic acid

Systemtic Name: 5-tert-butyl-2-[naphthalen-1-yl(phenyl)amino]benzene-1,3-dicarboxylic acid Openeye Name: 5-tert-butyl-2-[N-(1-naphthyl)anilino]benzene-1,3-dicarboxylic acid CAS Name: 5-tert-butyl-2-[N-(1-naphthalenyl)anilino]benzene-1,3-dicarboxylic acid IUPAC Name: 5-tert-butyl-2-(N-naphthalen-1-ylanilino)benzene-1,3-dicarboxylic acid Traditional Name: 5-tert-butyl-2-[N-(1-naphthyl)anilino]isophthalic acid Formula: C28H25NO4 MolecularWeight: 439.5024

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)N(C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43)C(=O)O

Isomeric SMILES

CC(C)(C)C1=CC(=C(C(=C1)C(=O)O)N(C2=CC=CC=C2)C3=CC=CC4=CC=CC=C43)C(=O)O

InChI

InChI=1S/C28H25NO4/c1-28(2,3)19-16-22(26(30)31)25(23(17-19)27(32)33)29(20-12-5-4-6-13-20)24-15-9-11-18-10-7-8-14-21(18)24/h4-17H,1-3H3,(H,30,31)(H,32,33)