2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate

Systemtic Name: 2-[(4-bromanyl-3-methyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate Openeye Name: 2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate CAS Name: 2-[(4-bromo-3-methylphenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate IUPAC Name: 2-[(4-bromo-3-methylphenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate Traditional Name: 2-[(4-bromo-3-methyl-phenyl)sulfonylamino]-5-methoxy-4-(2-methoxyethoxy)benzoate Formula: C18H19BrNO7S- MolecularWeight: 473.31496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OCCOC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)S(=O)(=O)NC2=CC(=C(C=C2C(=O)[O-])OC)OCCOC)Br

InChI

InChI=1S/C18H20BrNO7S/c1-11-8-12(4-5-14(11)19)28(23,24)20-15-10-17(27-7-6-25-2)16(26-3)9-13(15)18(21)22/h4-5,8-10,20H,6-7H2,1-3H3,(H,21,22)/p-1