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2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]-5-oxidanyl-thiophen-3-one

2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]-5-oxidanyl-thiophen-3-one

Systemtic Name:2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]-5-oxidanyl-thiophen-3-one
Openeye Name:5-hydroxy-2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]thiophen-3-one
CAS Name:5-hydroxy-2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]-3-thiophenone
IUPAC Name:5-hydroxy-2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]thiophen-3-one
Traditional Name:5-hydroxy-2,4-dimethyl-2-[3-(4-nitrophenyl)prop-2-ynyl]thiophen-3-one
Formula: C15H13NO4S
MolecularWeight: 303.33302
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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(C1=O)(C)CC#CC2=CC=C(C=C2)[N+](=O)[O-])O


Isomeric SMILES

CC1=C(SC(C1=O)(C)CC#CC2=CC=C(C=C2)[N+](=O)[O-])O


InChI

InChI=1S/C15H13NO4S/c1-10-13(17)15(2,21-14(10)18)9-3-4-11-5-7-12(8-6-11)16(19)20/h5-8,18H,9H2,1-2H3


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