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3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitro-chromen-2-one

3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitro-chromen-2-one

Systemtic Name:3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitro-chromen-2-one
Openeye Name:3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitro-chromen-2-one
CAS Name:3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitro-1-benzopyran-2-one
IUPAC Name:3-[(4-methoxyphenyl)methylsulfonyl]-6,8-dinitrochromen-2-one
Traditional Name:6,8-dinitro-3-p-anisylsulfonyl-coumarin
Formula: C17H12N2O9S
MolecularWeight: 420.35018
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CS(=O)(=O)C2=CC3=CC(=CC(=C3OC2=O)[N+](=O)[O-])[N+](=O)[O-]


Isomeric SMILES

COC1=CC=C(C=C1)CS(=O)(=O)C2=CC3=CC(=CC(=C3OC2=O)[N+](=O)[O-])[N+](=O)[O-]


InChI

InChI=1S/C17H12N2O9S/c1-27-13-4-2-10(3-5-13)9-29(25,26)15-7-11-6-12(18(21)22)8-14(19(23)24)16(11)28-17(15)20/h2-8H,9H2,1H3


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