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

Systemtic Name: N-[2-[4-(3,3-diphenylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(3,3-diphenylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-(1-oxo-3,3-diphenylpropyl)-1-piperazinyl]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(3,3-diphenylpropanoyl)piperazin-1-yl]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(3,3-diphenylpropanoyl)piperazino]ethyl]-piperonylamide Formula: C29H31N3O4 MolecularWeight: 485.57414

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CCNC(=O)C2=CC3=C(C=C2)OCO3)C(=O)CC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H31N3O4/c33-28(20-25(22-7-3-1-4-8-22)23-9-5-2-6-10-23)32-17-15-31(16-18-32)14-13-30-29(34)24-11-12-26-27(19-24)36-21-35-26/h1-12,19,25H,13-18,20-21H2,(H,30,34)