2-(2-ethylhexanoylamino)-5-methyl-benzoic acid

Systemtic Name: 2-(2-ethylhexanoylamino)-5-methyl-benzoic acid Openeye Name: 2-(2-ethylhexanoylamino)-5-methyl-benzoic acid CAS Name: 2-[(2-ethyl-1-oxohexyl)amino]-5-methylbenzoic acid IUPAC Name: 2-(2-ethylhexanoylamino)-5-methylbenzoic acid Traditional Name: 2-(2-ethylhexanoylamino)-5-methyl-benzoic acid Formula: C16H23NO3 MolecularWeight: 277.35872

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C=C(C=C1)C)C(=O)O

Isomeric SMILES

CCCCC(CC)C(=O)NC1=C(C=C(C=C1)C)C(=O)O

InChI

InChI=1S/C16H23NO3/c1-4-6-7-12(5-2)15(18)17-14-9-8-11(3)10-13(14)16(19)20/h8-10,12H,4-7H2,1-3H3,(H,17,18)(H,19,20)