N-[2-[4-(3,4-diethoxyphenyl)carbonylpiperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[4-(3,4-diethoxyphenyl)carbonylpiperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(3,4-diethoxybenzoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-[(3,4-diethoxyphenyl)-oxomethyl]-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(3,4-diethoxybenzoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(3,4-diethoxybenzoyl)piperazino]ethyl]-piperonylamide Formula: C25H31N3O6 MolecularWeight: 469.53014

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC4=C(C=C3)OCO4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CCNC(=O)C3=CC4=C(C=C3)OCO4)OCC

InChI

InChI=1S/C25H31N3O6/c1-3-31-20-8-6-19(16-22(20)32-4-2)25(30)28-13-11-27(12-14-28)10-9-26-24(29)18-5-7-21-23(15-18)34-17-33-21/h5-8,15-16H,3-4,9-14,17H2,1-2H3,(H,26,29)