3-(butylcarbamoylamino)-4-chloranyl-benzoate

Systemtic Name: 3-(butylcarbamoylamino)-4-chloranyl-benzoate Openeye Name: 3-(butylcarbamoylamino)-4-chloro-benzoate CAS Name: 3-[[butylamino(oxo)methyl]amino]-4-chlorobenzoate IUPAC Name: 3-(butylcarbamoylamino)-4-chlorobenzoate Traditional Name: 3-(butylcarbamoylamino)-4-chloro-benzoate Formula: C12H14ClN2O3- MolecularWeight: 269.70416

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15ClN2O3/c1-2-3-6-14-12(18)15-10-7-8(11(16)17)4-5-9(10)13/h4-5,7H,2-3,6H2,1H3,(H,16,17)(H2,14,15,18)/p-1