[(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-propoxy-benzoate

Systemtic Name: [(2S)-1-(aminocarbonylamino)-1-oxidanylidene-propan-2-yl] 3-ethoxy-4-propoxy-benzoate Openeye Name: [(1S)-1-methyl-2-oxo-2-ureido-ethyl] 3-ethoxy-4-propoxy-benzoate CAS Name: 3-ethoxy-4-propoxybenzoic acid [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(carbamoylamino)-1-oxopropan-2-yl] 3-ethoxy-4-propoxybenzoate Traditional Name: 3-ethoxy-4-propoxy-benzoic acid [(1S)-2-keto-1-methyl-2-ureido-ethyl] ester Formula: C16H22N2O6 MolecularWeight: 338.35568

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(=O)OC(C)C(=O)NC(=O)N)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)C(=O)O[C@@H](C)C(=O)NC(=O)N)OCC

InChI

InChI=1S/C16H22N2O6/c1-4-8-23-12-7-6-11(9-13(12)22-5-2)15(20)24-10(3)14(19)18-16(17)21/h6-7,9-10H,4-5,8H2,1-3H3,(H3,17,18,19,21)/t10-/m0/s1