[2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-methoxy-4-propoxy-benzoate

Systemtic Name: [2-(cyclopentylcarbamoylamino)-2-oxidanylidene-ethyl] 3-bromanyl-5-methoxy-4-propoxy-benzoate Openeye Name: [2-(cyclopentylcarbamoylamino)-2-oxo-ethyl] 3-bromo-5-methoxy-4-propoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-propoxybenzoic acid [2-[[(cyclopentylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(cyclopentylcarbamoylamino)-2-oxoethyl] 3-bromo-5-methoxy-4-propoxybenzoate Traditional Name: 3-bromo-5-methoxy-4-propoxy-benzoic acid [2-(cyclopentylcarbamoylamino)-2-keto-ethyl] ester Formula: C19H25BrN2O6 MolecularWeight: 457.3156

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NC(=O)NC2CCCC2)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)OCC(=O)NC(=O)NC2CCCC2)OC

InChI

InChI=1S/C19H25BrN2O6/c1-3-8-27-17-14(20)9-12(10-15(17)26-2)18(24)28-11-16(23)22-19(25)21-13-6-4-5-7-13/h9-10,13H,3-8,11H2,1-2H3,(H2,21,22,23,25)