1-[2-[(4-bromophenyl)methoxycarbonylamino]ethanoylamino]ethylphosphonous acid

Systemtic Name: 1-[2-[(4-bromophenyl)methoxycarbonylamino]ethanoylamino]ethylphosphonous acid Openeye Name: 1-[[2-[(4-bromophenyl)methoxycarbonylamino]acetyl]amino]ethylphosphonous acid CAS Name: 1-[[2-[[(4-bromophenyl)methoxy-oxomethyl]amino]-1-oxoethyl]amino]ethylphosphonous acid IUPAC Name: 1-[[2-[(4-bromophenyl)methoxycarbonylamino]acetyl]amino]ethylphosphonous acid Traditional Name: 1-[[2-[(4-bromobenzyl)oxycarbonylamino]acetyl]amino]ethylphosphonous acid Formula: C12H16BrN2O5P MolecularWeight: 379.143601

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Descriptors Computed from Structure

Canonical SMILES:

CC(NC(=O)CNC(=O)OCC1=CC=C(C=C1)Br)P(O)O

Isomeric SMILES

CC(NC(=O)CNC(=O)OCC1=CC=C(C=C1)Br)P(O)O

InChI

InChI=1S/C12H16BrN2O5P/c1-8(21(18)19)15-11(16)6-14-12(17)20-7-9-2-4-10(13)5-3-9/h2-5,8,18-19H,6-7H2,1H3,(H,14,17)(H,15,16)