[azanyl-[3-[(4-bromophenyl)methoxycarbonylamino]-2-oxidanylidene-piperidin-1-yl]phosphoryl]sulfamic acid

Systemtic Name: [azanyl-[3-[(4-bromophenyl)methoxycarbonylamino]-2-oxidanylidene-piperidin-1-yl]phosphoryl]sulfamic acid Openeye Name: [amino-[3-[(4-bromophenyl)methoxycarbonylamino]-2-oxo-1-piperidyl]phosphoryl]sulfamic acid CAS Name: [amino-[3-[[(4-bromophenyl)methoxy-oxomethyl]amino]-2-oxo-1-piperidinyl]phosphoryl]sulfamic acid IUPAC Name: [amino-[3-[(4-bromophenyl)methoxycarbonylamino]-2-oxopiperidin-1-yl]phosphoryl]sulfamic acid Traditional Name: [amino-[3-[(4-bromobenzyl)oxycarbonylamino]-2-keto-piperidino]phosphoryl]sulfamic acid Formula: C13H18BrN4O7PS MolecularWeight: 485.247381

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(=O)N(C1)P(=O)(N)NS(=O)(=O)O)NC(=O)OCC2=CC=C(C=C2)Br

Isomeric SMILES

C1CC(C(=O)N(C1)P(=O)(N)NS(=O)(=O)O)NC(=O)OCC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H18BrN4O7PS/c14-10-5-3-9(4-6-10)8-25-13(20)16-11-2-1-7-18(12(11)19)26(15,21)17-27(22,23)24/h3-6,11H,1-2,7-8H2,(H,16,20)(H3,15,17,21)(H,22,23,24)