3-azanyl-4-bromanyl-2-methoxy-6-naphthalen-2-yl-phenol phosphate

Systemtic Name: 3-azanyl-4-bromanyl-2-methoxy-6-naphthalen-2-yl-phenol phosphate Openeye Name: 3-amino-4-bromo-2-methoxy-6-(2-naphthyl)phenol phosphate CAS Name: 3-amino-4-bromo-2-methoxy-6-(2-naphthalenyl)phenol phosphate IUPAC Name: 3-amino-4-bromo-2-methoxy-6-naphthalen-2-ylphenol phosphate Traditional Name: 3-amino-4-bromo-2-methoxy-6-(2-naphthyl)phenol phosphate Formula: C17H14BrNO6P-3 MolecularWeight: 439.173921

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1N)Br)C2=CC3=CC=CC=C3C=C2)O.[O-]P(=O)([O-])[O-]

Isomeric SMILES

COC1=C(C(=CC(=C1N)Br)C2=CC3=CC=CC=C3C=C2)O.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C17H14BrNO2.H3O4P/c1-21-17-15(19)14(18)9-13(16(17)20)12-7-6-10-4-2-3-5-11(10)8-12;1-5(2,3)4/h2-9,20H,19H2,1H3;(H3,1,2,3,4)/p-3