methyl 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoyl-phenoxy)ethanoate

Systemtic Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoyl-phenoxy)ethanoate Openeye Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoyl-phenoxy)acetate CAS Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoylphenoxy)acetic acid methyl ester IUPAC Name: methyl 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoylphenoxy)acetate Traditional Name: 2-(1,3-benzodioxol-5-yl)-2-(2-propyl-4-sulfamoyl-phenoxy)acetic acid methyl ester Formula: C19H21NO7S MolecularWeight: 407.43754

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)S(=O)(=O)N)OC(C2=CC3=C(C=C2)OCO3)C(=O)OC

Isomeric SMILES

CCCC1=C(C=CC(=C1)S(=O)(=O)N)OC(C2=CC3=C(C=C2)OCO3)C(=O)OC

InChI

InChI=1S/C19H21NO7S/c1-3-4-12-9-14(28(20,22)23)6-8-15(12)27-18(19(21)24-2)13-5-7-16-17(10-13)26-11-25-16/h5-10,18H,3-4,11H2,1-2H3,(H2,20,22,23)