N-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethanoylphenyl)sulfonylamino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-3-[(3-ethanoylphenyl)sulfonylamino]propanamide Openeye Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzodioxol-5-ylmethyl)propanamide CAS Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzodioxol-5-ylmethyl)propanamide IUPAC Name: 3-[(3-acetylphenyl)sulfonylamino]-N-(1,3-benzodioxol-5-ylmethyl)propanamide Traditional Name: 3-[(3-acetylphenyl)sulfonylamino]-N-piperonyl-propionamide Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)S(=O)(=O)NCCC(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H20N2O6S/c1-13(22)15-3-2-4-16(10-15)28(24,25)21-8-7-19(23)20-11-14-5-6-17-18(9-14)27-12-26-17/h2-6,9-10,21H,7-8,11-12H2,1H3,(H,20,23)