(3-morpholin-4-ylsulfonylphenyl)methyl 1,3-benzodioxole-5-carboxylate

Systemtic Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1,3-benzodioxole-5-carboxylate Openeye Name: (3-morpholinosulfonylphenyl)methyl 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [3-(4-morpholinylsulfonyl)phenyl]methyl ester IUPAC Name: (3-morpholin-4-ylsulfonylphenyl)methyl 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (3-morpholinosulfonylbenzyl) ester Formula: C19H19NO7S MolecularWeight: 405.42166

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=CC(=C2)COC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H19NO7S/c21-19(15-4-5-17-18(11-15)27-13-26-17)25-12-14-2-1-3-16(10-14)28(22,23)20-6-8-24-9-7-20/h1-5,10-11H,6-9,12-13H2