5-chloranyl-2-[[(2S)-2-ethylhexanoyl]amino]benzoate

Systemtic Name: 5-chloranyl-2-[[(2S)-2-ethylhexanoyl]amino]benzoate Openeye Name: 5-chloro-2-[[(2S)-2-ethylhexanoyl]amino]benzoate CAS Name: 5-chloro-2-[[(2S)-2-ethyl-1-oxohexyl]amino]benzoate IUPAC Name: 5-chloro-2-[[(2S)-2-ethylhexanoyl]amino]benzoate Traditional Name: 5-chloro-2-[[(2S)-2-ethylhexanoyl]amino]benzoate Formula: C15H19ClNO3- MolecularWeight: 296.76926

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=C(C=C(C=C1)Cl)C(=O)[O-]

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=C(C=C(C=C1)Cl)C(=O)[O-]

InChI

InChI=1S/C15H20ClNO3/c1-3-5-6-10(4-2)14(18)17-13-8-7-11(16)9-12(13)15(19)20/h7-10H,3-6H2,1-2H3,(H,17,18)(H,19,20)/p-1/t10-/m0/s1