5-(7-bromanyl-4H-quinoxalin-1-yl)-2-[ethoxy(propylsulfanyl)phosphoryl]oxy-phenol

Systemtic Name: 5-(7-bromanyl-4H-quinoxalin-1-yl)-2-[ethoxy(propylsulfanyl)phosphoryl]oxy-phenol Openeye Name: 5-(7-bromo-4H-quinoxalin-1-yl)-2-[ethoxy(propylsulfanyl)phosphoryl]oxy-phenol CAS Name: 5-(7-bromo-4H-quinoxalin-1-yl)-2-[ethoxy-(propylthio)phosphoryl]oxyphenol IUPAC Name: 5-(7-bromo-4H-quinoxalin-1-yl)-2-[ethoxy(propylsulfanyl)phosphoryl]oxyphenol Traditional Name: 5-(7-bromo-4H-quinoxalin-1-yl)-2-[ethoxy-(propylthio)phosphoryl]oxy-phenol Formula: C19H22BrN2O4PS MolecularWeight: 485.331741

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Descriptors Computed from Structure

Canonical SMILES:

CCCSP(=O)(OCC)OC1=C(C=C(C=C1)N2C=CNC3=C2C=C(C=C3)Br)O

Isomeric SMILES

CCCSP(=O)(OCC)OC1=C(C=C(C=C1)N2C=CNC3=C2C=C(C=C3)Br)O

InChI

InChI=1S/C19H22BrN2O4PS/c1-3-11-28-27(24,25-4-2)26-19-8-6-15(13-18(19)23)22-10-9-21-16-7-5-14(20)12-17(16)22/h5-10,12-13,21,23H,3-4,11H2,1-2H3