(2-nitrophenyl) 3-methylquinoline-8-sulfonate

Systemtic Name: (2-nitrophenyl) 3-methylquinoline-8-sulfonate Openeye Name: (2-nitrophenyl) 3-methylquinoline-8-sulfonate CAS Name: 3-methyl-8-quinolinesulfonic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 3-methylquinoline-8-sulfonate Traditional Name: 3-methylquinoline-8-sulfonic acid (2-nitrophenyl) ester Formula: C16H12N2O5S MolecularWeight: 344.34188

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C2C(=C1)C=CC=C2S(=O)(=O)OC3=CC=CC=C3[N+](=O)[O-]

InChI

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