5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid

Systemtic Name: 5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid Openeye Name: 5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid CAS Name: 5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid IUPAC Name: 5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid Traditional Name: 5-(dimethylamino)-2,3-bis[dimethylamino(diphenyl)methyl]benzoic acid Formula: C39H41N3O2 MolecularWeight: 583.76174

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC(=C(C(=C1)C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)N(C)C)C(C4=CC=CC=C4)(C5=CC=CC=C5)N(C)C

Isomeric SMILES

CN(C)C1=CC(=C(C(=C1)C(=O)O)C(C2=CC=CC=C2)(C3=CC=CC=C3)N(C)C)C(C4=CC=CC=C4)(C5=CC=CC=C5)N(C)C

InChI

InChI=1S/C39H41N3O2/c1-40(2)33-27-34(37(43)44)36(39(42(5)6,31-23-15-9-16-24-31)32-25-17-10-18-26-32)35(28-33)38(41(3)4,29-19-11-7-12-20-29)30-21-13-8-14-22-30/h7-28H,1-6H3,(H,43,44)