(2-chloranyl-4-nitro-phenyl) 3-methylquinoline-8-sulfonate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 3-methylquinoline-8-sulfonate Openeye Name: (2-chloro-4-nitro-phenyl) 3-methylquinoline-8-sulfonate CAS Name: 3-methyl-8-quinolinesulfonic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 3-methylquinoline-8-sulfonate Traditional Name: 3-methylquinoline-8-sulfonic acid (2-chloro-4-nitro-phenyl) ester Formula: C16H11ClN2O5S MolecularWeight: 378.78694

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11ClN2O5S/c1-10-7-11-3-2-4-15(16(11)18-9-10)25(22,23)24-14-6-5-12(19(20)21)8-13(14)17/h2-9H,1H3