3-(2-ethylundecanoylamino)-4-methyl-benzoic acid

Systemtic Name: 3-(2-ethylundecanoylamino)-4-methyl-benzoic acid Openeye Name: 3-(2-ethylundecanoylamino)-4-methyl-benzoic acid CAS Name: 3-[(2-ethyl-1-oxoundecyl)amino]-4-methylbenzoic acid IUPAC Name: 3-(2-ethylundecanoylamino)-4-methylbenzoic acid Traditional Name: 3-(2-ethylundecanoylamino)-4-methyl-benzoic acid Formula: C21H33NO3 MolecularWeight: 347.49162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H33NO3/c1-4-6-7-8-9-10-11-12-17(5-2)20(23)22-19-15-18(21(24)25)14-13-16(19)3/h13-15,17H,4-12H2,1-3H3,(H,22,23)(H,24,25)