(5-bromanyl-4-chloranyl-1H-indol-3-yl)oxy-phenyl-phosphinic acid; 4-methylaniline

Systemtic Name: (5-bromanyl-4-chloranyl-1H-indol-3-yl)oxy-phenyl-phosphinic acid; 4-methylaniline Openeye Name: (5-bromo-4-chloro-1H-indol-3-yl)oxy-phenyl-phosphinic acid; 4-methylaniline CAS Name: (5-bromo-4-chloro-1H-indol-3-yl)oxy-phenylphosphinic acid; 4-methylaniline IUPAC Name: (5-bromo-4-chloro-1H-indol-3-yl)oxy-phenylphosphinic acid; 4-methylaniline Traditional Name: (5-bromo-4-chloro-1H-indol-3-yl)oxy-phenyl-phosphinic acid; p-toluidine Formula: C21H19BrClN2O3P MolecularWeight: 493.717921

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N.C1=CC=C(C=C1)P(=O)(O)OC2=CNC3=C2C(=C(C=C3)Br)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N.C1=CC=C(C=C1)P(=O)(O)OC2=CNC3=C2C(=C(C=C3)Br)Cl

InChI

InChI=1S/C14H10BrClNO3P.C7H9N/c15-10-6-7-11-13(14(10)16)12(8-17-11)20-21(18,19)9-4-2-1-3-5-9;1-6-2-4-7(8)5-3-6/h1-8,17H,(H,18,19);2-5H,8H2,1H3