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

Systemtic Name: 2-[bis[4-(dibutylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid Openeye Name: 2-[bis[4-(dibutylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid CAS Name: 2-[bis[4-(dibutylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid IUPAC Name: 2-[bis[4-(dibutylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid Traditional Name: 2-[bis[4-(dibutylamino)phenyl]methyl]-5-(dimethylamino)benzoic acid Formula: C38H55N3O2 MolecularWeight: 585.8622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCCC)CCCC)C3=C(C=C(C=C3)N(C)C)C(=O)O

Isomeric SMILES

CCCCN(CCCC)C1=CC=C(C=C1)C(C2=CC=C(C=C2)N(CCCC)CCCC)C3=C(C=C(C=C3)N(C)C)C(=O)O

InChI

InChI=1S/C38H55N3O2/c1-7-11-25-40(26-12-8-2)32-19-15-30(16-20-32)37(35-24-23-34(39(5)6)29-36(35)38(42)43)31-17-21-33(22-18-31)41(27-13-9-3)28-14-10-4/h15-24,29,37H,7-14,25-28H2,1-6H3,(H,42,43)