[2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate

Systemtic Name: [2-(cyclopropylcarbamoylamino)-2-oxidanylidene-ethyl] 4-butoxy-3-chloranyl-5-ethoxy-benzoate Openeye Name: [2-(cyclopropylcarbamoylamino)-2-oxo-ethyl] 4-butoxy-3-chloro-5-ethoxy-benzoate CAS Name: 4-butoxy-3-chloro-5-ethoxybenzoic acid [2-[[(cyclopropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopropylcarbamoylamino)-2-oxoethyl] 4-butoxy-3-chloro-5-ethoxybenzoate Traditional Name: 4-butoxy-3-chloro-5-ethoxy-benzoic acid [2-(cyclopropylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H25ClN2O6 MolecularWeight: 412.8646

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC2CC2)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1Cl)C(=O)OCC(=O)NC(=O)NC2CC2)OCC

InChI

InChI=1S/C19H25ClN2O6/c1-3-5-8-27-17-14(20)9-12(10-15(17)26-4-2)18(24)28-11-16(23)22-19(25)21-13-6-7-13/h9-10,13H,3-8,11H2,1-2H3,(H2,21,22,23,25)