2-ethyl-3-(7-methyloctanoylamino)benzoate

Systemtic Name: 2-ethyl-3-(7-methyloctanoylamino)benzoate Openeye Name: 2-ethyl-3-(7-methyloctanoylamino)benzoate CAS Name: 2-ethyl-3-[(7-methyl-1-oxooctyl)amino]benzoate IUPAC Name: 2-ethyl-3-(7-methyloctanoylamino)benzoate Traditional Name: 2-ethyl-3-(7-methyloctanoylamino)benzoate Formula: C18H26NO3- MolecularWeight: 304.40394

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC=C1NC(=O)CCCCCC(C)C)C(=O)[O-]

Isomeric SMILES

CCC1=C(C=CC=C1NC(=O)CCCCCC(C)C)C(=O)[O-]

InChI

InChI=1S/C18H27NO3/c1-4-14-15(18(21)22)10-8-11-16(14)19-17(20)12-7-5-6-9-13(2)3/h8,10-11,13H,4-7,9,12H2,1-3H3,(H,19,20)(H,21,22)/p-1