N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxyphenyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(4-chlorophenyl)sulfonyl-5-methoxy-phenyl]-piperonylamide Formula: C21H16ClNO6S MolecularWeight: 445.87284

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=CC3=C(C=C2)OCO3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H16ClNO6S/c1-27-16-9-15(23-21(24)13-2-7-19-20(8-13)29-12-28-19)10-18(11-16)30(25,26)17-5-3-14(22)4-6-17/h2-11H,12H2,1H3,(H,23,24)