2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid

Systemtic Name: 2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid Openeye Name: 2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid CAS Name: 2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid IUPAC Name: 2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid Traditional Name: 2-[bis(4-dimethylaminophenyl)methyl]-5-(dimethylamino)benzoic acid Formula: C26H31N3O2 MolecularWeight: 417.54324

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=C(C=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(C)C)C3=C(C=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C26H31N3O2/c1-27(2)20-11-7-18(8-12-20)25(19-9-13-21(14-10-19)28(3)4)23-16-15-22(29(5)6)17-24(23)26(30)31/h7-17,25H,1-6H3,(H,30,31)