4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxidanylidene-naphthalene-2-carboxylic acid

Systemtic Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxidanylidene-naphthalene-2-carboxylic acid Openeye Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazono]-3-oxo-naphthalene-2-carboxylic acid CAS Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxo-2-naphthalenecarboxylic acid IUPAC Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazinylidene]-3-oxonaphthalene-2-carboxylic acid Traditional Name: 4-[[4-[bis(2-chloroethyl)sulfamoyl]phenyl]hydrazono]-3-keto-2-naphthoic acid Formula: C21H19Cl2N3O5S MolecularWeight: 496.36366

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)N(CCCl)CCCl)C(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=C(C(=O)C2=NNC3=CC=C(C=C3)S(=O)(=O)N(CCCl)CCCl)C(=O)O

InChI

InChI=1S/C21H19Cl2N3O5S/c22-9-11-26(12-10-23)32(30,31)16-7-5-15(6-8-16)24-25-19-17-4-2-1-3-14(17)13-18(20(19)27)21(28)29/h1-8,13,24H,9-12H2,(H,28,29)