N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxidanylidene-propyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxo-propyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[3-[2-(3,4-dimethoxyphenyl)ethylamino]-3-oxopropyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[3-(homoveratrylamino)-3-keto-propyl]-piperonylamide Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CCNC(=O)C2=CC3=C(C=C2)OCO3)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CCNC(=O)C2=CC3=C(C=C2)OCO3)OC

InChI

InChI=1S/C21H24N2O6/c1-26-16-5-3-14(11-18(16)27-2)7-9-22-20(24)8-10-23-21(25)15-4-6-17-19(12-15)29-13-28-17/h3-6,11-12H,7-10,13H2,1-2H3,(H,22,24)(H,23,25)