7-bromanyl-4-[(2-methoxy-5-nitro-phenoxy)methyl]chromen-2-one

Systemtic Name: 7-bromanyl-4-[(2-methoxy-5-nitro-phenoxy)methyl]chromen-2-one Openeye Name: 7-bromo-4-[(2-methoxy-5-nitro-phenoxy)methyl]chromen-2-one CAS Name: 7-bromo-4-[(2-methoxy-5-nitrophenoxy)methyl]-1-benzopyran-2-one IUPAC Name: 7-bromo-4-[(2-methoxy-5-nitrophenoxy)methyl]chromen-2-one Traditional Name: 7-bromo-4-[(2-methoxy-5-nitro-phenoxy)methyl]coumarin Formula: C17H12BrNO6 MolecularWeight: 406.18428

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC(=O)OC3=C2C=CC(=C3)Br

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])OCC2=CC(=O)OC3=C2C=CC(=C3)Br

InChI

InChI=1S/C17H12BrNO6/c1-23-14-5-3-12(19(21)22)8-16(14)24-9-10-6-17(20)25-15-7-11(18)2-4-13(10)15/h2-8H,9H2,1H3