[2-(aminocarbonylamino)-1-chloranyl-2-oxidanylidene-ethyl]phosphonic acid; quinolin-8-ol

Systemtic Name: [2-(aminocarbonylamino)-1-chloranyl-2-oxidanylidene-ethyl]phosphonic acid; quinolin-8-ol Openeye Name: (1-chloro-2-oxo-2-ureido-ethyl)phosphonic acid; quinolin-8-ol CAS Name: [2-(carbamoylamino)-1-chloro-2-oxoethyl]phosphonic acid; 8-quinolinol IUPAC Name: [2-(carbamoylamino)-1-chloro-2-oxoethyl]phosphonic acid; quinolin-8-ol Traditional Name: (1-chloro-2-keto-2-ureido-ethyl)phosphonic acid; oxine Formula: C12H13ClN3O6P MolecularWeight: 361.674881

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)O)N=CC=C2.C(C(=O)NC(=O)N)(P(=O)(O)O)Cl

Isomeric SMILES

C1=CC2=C(C(=C1)O)N=CC=C2.C(C(=O)NC(=O)N)(P(=O)(O)O)Cl

InChI

InChI=1S/C9H7NO.C3H6ClN2O5P/c11-8-5-1-3-7-4-2-6-10-9(7)8;4-1(12(9,10)11)2(7)6-3(5)8/h1-6,11H;1H,(H2,9,10,11)(H3,5,6,7,8)