[(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-iodanylphenyl)carbonylamino]ethanoate

Systemtic Name: [(2S)-1-(ethylcarbamoylamino)-1-oxidanylidene-propan-2-yl] 2-[(2-iodanylphenyl)carbonylamino]ethanoate Openeye Name: [(1S)-2-(ethylcarbamoylamino)-1-methyl-2-oxo-ethyl] 2-[(2-iodobenzoyl)amino]acetate CAS Name: 2-[[(2-iodophenyl)-oxomethyl]amino]acetic acid [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 2-[(2-iodobenzoyl)amino]acetate Traditional Name: 2-[(2-iodobenzoyl)amino]acetic acid [(1S)-2-(ethylcarbamoylamino)-2-keto-1-methyl-ethyl] ester Formula: C15H18IN3O5 MolecularWeight: 447.22499

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC(=O)CNC(=O)C1=CC=CC=C1I

Isomeric SMILES

CCNC(=O)NC(=O)[C@H](C)OC(=O)CNC(=O)C1=CC=CC=C1I

InChI

InChI=1S/C15H18IN3O5/c1-3-17-15(23)19-13(21)9(2)24-12(20)8-18-14(22)10-6-4-5-7-11(10)16/h4-7,9H,3,8H2,1-2H3,(H,18,22)(H2,17,19,21,23)/t9-/m0/s1