[2-(butylamino)-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate

Systemtic Name: [2-(butylamino)-2-oxidanylidene-ethyl] 3-azanyl-4-chloranyl-benzoate Openeye Name: [2-(butylamino)-2-oxo-ethyl] 3-amino-4-chloro-benzoate CAS Name: 3-amino-4-chlorobenzoic acid [2-(butylamino)-2-oxoethyl] ester IUPAC Name: [2-(butylamino)-2-oxoethyl] 3-amino-4-chlorobenzoate Traditional Name: 3-amino-4-chloro-benzoic acid [2-(butylamino)-2-keto-ethyl] ester Formula: C13H17ClN2O3 MolecularWeight: 284.73868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

Isomeric SMILES

CCCCNC(=O)COC(=O)C1=CC(=C(C=C1)Cl)N

InChI

InChI=1S/C13H17ClN2O3/c1-2-3-6-16-12(17)8-19-13(18)9-4-5-10(14)11(15)7-9/h4-5,7H,2-3,6,8,15H2,1H3,(H,16,17)