(4-methyl-2-nitro-phenyl) quinoline-8-sulfonate

Systemtic Name: (4-methyl-2-nitro-phenyl) quinoline-8-sulfonate Openeye Name: (4-methyl-2-nitro-phenyl) quinoline-8-sulfonate CAS Name: 8-quinolinesulfonic acid (4-methyl-2-nitrophenyl) ester IUPAC Name: (4-methyl-2-nitrophenyl) quinoline-8-sulfonate Traditional Name: quinoline-8-sulfonic acid (4-methyl-2-nitro-phenyl) ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OS(=O)(=O)C2=CC=CC3=C2N=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H12N2O5S/c1-11-7-8-14(13(10-11)18(19)20)23-24(21,22)15-6-2-4-12-5-3-9-17-16(12)15/h2-10H,1H3