2-[2-(4-chlorophenyl)sulfanylethanoyl]-4-methyl-6-nitro-phenolate

Systemtic Name: 2-[2-(4-chlorophenyl)sulfanylethanoyl]-4-methyl-6-nitro-phenolate Openeye Name: 2-[2-(4-chlorophenyl)sulfanylacetyl]-4-methyl-6-nitro-phenolate CAS Name: 2-[2-[(4-chlorophenyl)thio]-1-oxoethyl]-4-methyl-6-nitrophenolate IUPAC Name: 2-[2-(4-chlorophenyl)sulfanylacetyl]-4-methyl-6-nitrophenolate Traditional Name: 2-[2-[(4-chlorophenyl)thio]acetyl]-4-methyl-6-nitro-phenolate Formula: C15H11ClNO4S- MolecularWeight: 336.77014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C(=O)CSC2=CC=C(C=C2)Cl)[O-])[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C(=C1)C(=O)CSC2=CC=C(C=C2)Cl)[O-])[N+](=O)[O-]

InChI

InChI=1S/C15H12ClNO4S/c1-9-6-12(15(19)13(7-9)17(20)21)14(18)8-22-11-4-2-10(16)3-5-11/h2-7,19H,8H2,1H3/p-1