2-[3-[(2-ethyl-6-methyl-phenyl)amino]-6-(2-ethyl-6-methyl-phenyl)imino-xanthen-9-yl]benzoic acid

Systemtic Name: 2-[3-[(2-ethyl-6-methyl-phenyl)amino]-6-(2-ethyl-6-methyl-phenyl)imino-xanthen-9-yl]benzoic acid Openeye Name: 2-[3-(2-ethyl-6-methyl-anilino)-6-(2-ethyl-6-methyl-phenyl)imino-xanthen-9-yl]benzoic acid CAS Name: 2-[3-(2-ethyl-6-methylanilino)-6-(2-ethyl-6-methylphenyl)imino-9-xanthenyl]benzoic acid IUPAC Name: 2-[3-(2-ethyl-6-methylanilino)-6-(2-ethyl-6-methylphenyl)iminoxanthen-9-yl]benzoic acid Traditional Name: 2-[3-(2-ethyl-6-methyl-anilino)-6-(2-ethyl-6-methyl-phenyl)imino-xanthen-9-yl]benzoic acid Formula: C38H34N2O3 MolecularWeight: 566.68816

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC2=CC3=C(C=C2)C(=C4C=CC(=NC5=C(C=CC=C5CC)C)C=C4O3)C6=CC=CC=C6C(=O)O)C

Isomeric SMILES

CCC1=CC=CC(=C1NC2=CC3=C(C=C2)C(=C4C=CC(=NC5=C(C=CC=C5CC)C)C=C4O3)C6=CC=CC=C6C(=O)O)C

InChI

InChI=1S/C38H34N2O3/c1-5-25-13-9-11-23(3)36(25)39-27-17-19-31-33(21-27)43-34-22-28(40-37-24(4)12-10-14-26(37)6-2)18-20-32(34)35(31)29-15-7-8-16-30(29)38(41)42/h7-22,39H,5-6H2,1-4H3,(H,41,42)