4-[di(octan-3-yl)amino]benzoic acid

Systemtic Name: 4-[di(octan-3-yl)amino]benzoic acid Openeye Name: 4-[bis(1-ethylhexyl)amino]benzoic acid CAS Name: 4-[di(octan-3-yl)amino]benzoic acid IUPAC Name: 4-[di(octan-3-yl)amino]benzoic acid Traditional Name: 4-[bis(1-ethylhexyl)amino]benzoic acid Formula: C23H39NO2 MolecularWeight: 361.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)N(C1=CC=C(C=C1)C(=O)O)C(CC)CCCCC

Isomeric SMILES

CCCCCC(CC)N(C1=CC=C(C=C1)C(=O)O)C(CC)CCCCC

InChI

InChI=1S/C23H39NO2/c1-5-9-11-13-20(7-3)24(21(8-4)14-12-10-6-2)22-17-15-19(16-18-22)23(25)26/h15-18,20-21H,5-14H2,1-4H3,(H,25,26)