4-methyl-4-nitro-1-thiophen-2-yl-pentan-1-one

Systemtic Name: 4-methyl-4-nitro-1-thiophen-2-yl-pentan-1-one Openeye Name: 4-methyl-4-nitro-1-(2-thienyl)pentan-1-one CAS Name: 4-methyl-4-nitro-1-thiophen-2-yl-1-pentanone IUPAC Name: 4-methyl-4-nitro-1-thiophen-2-ylpentan-1-one Traditional Name: 4-methyl-4-nitro-1-(2-thienyl)pentan-1-one Formula: C10H13NO3S MolecularWeight: 227.28012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC(=O)C1=CC=CS1)[N+](=O)[O-]

Isomeric SMILES

CC(C)(CCC(=O)C1=CC=CS1)[N+](=O)[O-]

InChI

InChI=1S/C10H13NO3S/c1-10(2,11(13)14)6-5-8(12)9-4-3-7-15-9/h3-4,7H,5-6H2,1-2H3