O3-ethyl O6-propan-2-yl 4-[[4-(prop-2-enylsulfamoyl)phenyl]amino]quinoline-3,6-dicarboxylate

Systemtic Name: O3-ethyl O6-propan-2-yl 4-[[4-(prop-2-enylsulfamoyl)phenyl]amino]quinoline-3,6-dicarboxylate Openeye Name: O3-ethyl O6-isopropyl 4-[4-(allylsulfamoyl)anilino]quinoline-3,6-dicarboxylate CAS Name: 4-[4-(prop-2-enylsulfamoyl)anilino]quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-propan-2-yl ester IUPAC Name: 3-O-ethyl 6-O-propan-2-yl 4-[4-(prop-2-enylsulfamoyl)anilino]quinoline-3,6-dicarboxylate Traditional Name: 4-[4-(allylsulfamoyl)anilino]quinoline-3,6-dicarboxylic acid O3-ethyl ester O6-isopropyl ester Formula: C25H27N3O6S MolecularWeight: 497.56338

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)S(=O)(=O)NCC=C)C(=O)OC(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1NC3=CC=C(C=C3)S(=O)(=O)NCC=C)C(=O)OC(C)C

InChI

InChI=1S/C25H27N3O6S/c1-5-13-27-35(31,32)19-10-8-18(9-11-19)28-23-20-14-17(24(29)34-16(3)4)7-12-22(20)26-15-21(23)25(30)33-6-2/h5,7-12,14-16,27H,1,6,13H2,2-4H3,(H,26,28)