2-(3-ethylhexan-3-ylcarbamoyl)benzoate

Systemtic Name: 2-(3-ethylhexan-3-ylcarbamoyl)benzoate Openeye Name: 2-(1,1-diethylbutylcarbamoyl)benzoate CAS Name: 2-[(3-ethylhexan-3-ylamino)-oxomethyl]benzoate IUPAC Name: 2-(3-ethylhexan-3-ylcarbamoyl)benzoate Traditional Name: 2-(1,1-diethylbutylcarbamoyl)benzoate Formula: C16H22NO3- MolecularWeight: 276.35078

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC)(CC)NC(=O)C1=CC=CC=C1C(=O)[O-]

Isomeric SMILES

CCCC(CC)(CC)NC(=O)C1=CC=CC=C1C(=O)[O-]

InChI

InChI=1S/C16H23NO3/c1-4-11-16(5-2,6-3)17-14(18)12-9-7-8-10-13(12)15(19)20/h7-10H,4-6,11H2,1-3H3,(H,17,18)(H,19,20)/p-1