2-[2-ethylhexyl(methyl)carbamoyl]benzoic acid

Systemtic Name: 2-[2-ethylhexyl(methyl)carbamoyl]benzoic acid Openeye Name: 2-[2-ethylhexyl(methyl)carbamoyl]benzoic acid CAS Name: 2-[[2-ethylhexyl(methyl)amino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-ethylhexyl(methyl)carbamoyl]benzoic acid Traditional Name: 2-[2-ethylhexyl(methyl)carbamoyl]benzoic acid Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(C)C(=O)C1=CC=CC=C1C(=O)O

Isomeric SMILES

CCCCC(CC)CN(C)C(=O)C1=CC=CC=C1C(=O)O

InChI

InChI=1S/C17H25NO3/c1-4-6-9-13(5-2)12-18(3)16(19)14-10-7-8-11-15(14)17(20)21/h7-8,10-11,13H,4-6,9,12H2,1-3H3,(H,20,21)