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

Systemtic Name: N-[2-[4-(2-phenylethanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(2-phenylacetyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(1-oxo-2-phenylethyl)-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(2-phenylacetyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(2-phenylacetyl)piperazino]ethyl]-piperonylamide Formula: C22H25N3O4 MolecularWeight: 395.4516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC4=CC=CC=C4

InChI

InChI=1S/C22H25N3O4/c26-21(14-17-4-2-1-3-5-17)25-12-10-24(11-13-25)9-8-23-22(27)18-6-7-19-20(15-18)29-16-28-19/h1-7,15H,8-14,16H2,(H,23,27)