4-azanyl-2,3-bis(2-ethylhexyl)benzoic acid

Systemtic Name: 4-azanyl-2,3-bis(2-ethylhexyl)benzoic acid Openeye Name: 4-amino-2,3-bis(2-ethylhexyl)benzoic acid CAS Name: 4-amino-2,3-bis(2-ethylhexyl)benzoic acid IUPAC Name: 4-amino-2,3-bis(2-ethylhexyl)benzoic acid Traditional Name: 4-amino-2,3-bis(2-ethylhexyl)benzoic acid Formula: C23H39NO2 MolecularWeight: 361.56126

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CC1=C(C=CC(=C1CC(CC)CCCC)N)C(=O)O

Isomeric SMILES

CCCCC(CC)CC1=C(C=CC(=C1CC(CC)CCCC)N)C(=O)O

InChI

InChI=1S/C23H39NO2/c1-5-9-11-17(7-3)15-20-19(23(25)26)13-14-22(24)21(20)16-18(8-4)12-10-6-2/h13-14,17-18H,5-12,15-16,24H2,1-4H3,(H,25,26)