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4-bromanyl-2-nitro-6-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenolate

4-bromanyl-2-nitro-6-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenolate

Systemtic Name:4-bromanyl-2-nitro-6-[(3-oxidanylidene-1-benzothiophen-2-ylidene)methyl]phenolate
Openeye Name:4-bromo-2-nitro-6-[(3-oxobenzothiophen-2-ylidene)methyl]phenolate
CAS Name:4-bromo-2-nitro-6-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenolate
IUPAC Name:4-bromo-2-nitro-6-[(3-oxo-1-benzothiophen-2-ylidene)methyl]phenolate
Traditional Name:4-bromo-2-[(3-ketobenzothiophen-2-ylidene)methyl]-6-nitro-phenolate
Formula: C15H7BrNO4S-
MolecularWeight: 377.18938
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)S2


Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C(=CC3=CC(=CC(=C3[O-])[N+](=O)[O-])Br)S2


InChI

InChI=1S/C15H8BrNO4S/c16-9-5-8(14(18)11(7-9)17(20)21)6-13-15(19)10-3-1-2-4-12(10)22-13/h1-7,18H/p-1


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