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2-[(5-carboxy-2-chloranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid

2-[(5-carboxy-2-chloranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid

Systemtic Name:2-[(5-carboxy-2-chloranyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid
Openeye Name:2-[(5-carboxy-2-chloro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid
CAS Name:2-[(5-carboxy-2-chlorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid
IUPAC Name:2-[(5-carboxy-2-chlorophenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid
Traditional Name:2-[(5-carboxy-2-chloro-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoic acid
Formula: C18H18ClNO9S
MolecularWeight: 459.85482
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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl)C(=O)O)OC


Isomeric SMILES

COCCOC1=C(C=C(C(=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)Cl)C(=O)O)OC


InChI

InChI=1S/C18H18ClNO9S/c1-27-5-6-29-15-9-13(11(18(23)24)8-14(15)28-2)20-30(25,26)16-7-10(17(21)22)3-4-12(16)19/h3-4,7-9,20H,5-6H2,1-2H3,(H,21,22)(H,23,24)


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