1-(4-methoxyphenyl)-4-methyl-4-nitro-3-thiophen-2-yl-pentan-1-one

Systemtic Name: 1-(4-methoxyphenyl)-4-methyl-4-nitro-3-thiophen-2-yl-pentan-1-one Openeye Name: 1-(4-methoxyphenyl)-4-methyl-4-nitro-3-(2-thienyl)pentan-1-one CAS Name: 1-(4-methoxyphenyl)-4-methyl-4-nitro-3-thiophen-2-yl-1-pentanone IUPAC Name: 1-(4-methoxyphenyl)-4-methyl-4-nitro-3-thiophen-2-ylpentan-1-one Traditional Name: 1-(4-methoxyphenyl)-4-methyl-4-nitro-3-(2-thienyl)pentan-1-one Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(CC(=O)C1=CC=C(C=C1)OC)C2=CC=CS2)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C(CC(=O)C1=CC=C(C=C1)OC)C2=CC=CS2)[N+](=O)[O-]

InChI

InChI=1S/C17H19NO4S/c1-17(2,18(20)21)14(16-5-4-10-23-16)11-15(19)12-6-8-13(22-3)9-7-12/h4-10,14H,11H2,1-3H3