1-(4-methylthiophen-2-yl)-2-nitro-butan-1-ol

Systemtic Name: 1-(4-methylthiophen-2-yl)-2-nitro-butan-1-ol Openeye Name: 1-(4-methyl-2-thienyl)-2-nitro-butan-1-ol CAS Name: 1-(4-methyl-2-thiophenyl)-2-nitro-1-butanol IUPAC Name: 1-(4-methylthiophen-2-yl)-2-nitrobutan-1-ol Traditional Name: 1-(4-methyl-2-thienyl)-2-nitro-butan-1-ol Formula: C9H13NO3S MolecularWeight: 215.26942

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H13NO3S/c1-3-7(10(12)13)9(11)8-4-6(2)5-14-8/h4-5,7,9,11H,3H2,1-2H3