7-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide

Systemtic Name: 7-chloranyl-N-[(3,4-dimethoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Openeye Name: 7-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(2-thienylmethyl)-1,3-benzodioxole-5-carboxamide CAS Name: 7-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide IUPAC Name: 7-chloro-N-[(3,4-dimethoxyphenyl)methyl]-N-(thiophen-2-ylmethyl)-1,3-benzodioxole-5-carboxamide Traditional Name: 7-chloro-N-(2-thenyl)-N-veratryl-piperonylamide Formula: C22H20ClNO5S MolecularWeight: 445.9159

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN(CC2=CC=CS2)C(=O)C3=CC4=C(C(=C3)Cl)OCO4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CN(CC2=CC=CS2)C(=O)C3=CC4=C(C(=C3)Cl)OCO4)OC

InChI

InChI=1S/C22H20ClNO5S/c1-26-18-6-5-14(8-19(18)27-2)11-24(12-16-4-3-7-30-16)22(25)15-9-17(23)21-20(10-15)28-13-29-21/h3-10H,11-13H2,1-2H3