(4-bromanyl-3-chloranyl-indol-1-yl) dihydrogen phosphate; 2H-1,2,3,4-tetrazol-1-ium

Systemtic Name: (4-bromanyl-3-chloranyl-indol-1-yl) dihydrogen phosphate; 2H-1,2,3,4-tetrazol-1-ium Openeye Name: (4-bromo-3-chloro-indol-1-yl) dihydrogen phosphate; 2H-tetrazol-1-ium CAS Name: (4-bromo-3-chloro-1-indolyl) dihydrogen phosphate; 2H-tetrazol-1-ium IUPAC Name: (4-bromo-3-chloroindol-1-yl) dihydrogen phosphate; 2H-tetrazol-1-ium Traditional Name: (4-bromo-3-chloro-indol-1-yl) dihydrogen phosphate; 2H-tetrazol-1-ium Formula: C9H9BrClN5O4P+ MolecularWeight: 397.529621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C(=C1)Br)C(=CN2OP(=O)(O)O)Cl.C1=[NH+]NN=N1

Isomeric SMILES

C1=CC2=C(C(=C1)Br)C(=CN2OP(=O)(O)O)Cl.C1=[NH+]NN=N1

InChI

InChI=1S/C8H6BrClNO4P.CH2N4/c9-5-2-1-3-7-8(5)6(10)4-11(7)15-16(12,13)14;1-2-4-5-3-1/h1-4H,(H2,12,13,14);1H,(H,2,3,4,5)/p+1