ethyl 6-chloranyl-4-[[4-(prop-2-enylsulfamoyl)phenyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-4-[[4-(prop-2-enylsulfamoyl)phenyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(allylsulfamoyl)anilino]-6-chloro-quinoline-3-carboxylate CAS Name: 6-chloro-4-[4-(prop-2-enylsulfamoyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-4-[4-(prop-2-enylsulfamoyl)anilino]quinoline-3-carboxylate Traditional Name: 4-[4-(allylsulfamoyl)anilino]-6-chloro-quinoline-3-carboxylic acid ethyl ester Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C21H20ClN3O4S/c1-3-11-24-30(27,28)16-8-6-15(7-9-16)25-20-17-12-14(22)5-10-19(17)23-13-18(20)21(26)29-4-2/h3,5-10,12-13,24H,1,4,11H2,2H3,(H,23,25)