4-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-N-ethyl-piperazine-1-carboxamide

Systemtic Name: 4-[4-(1,3-benzodioxol-5-ylcarbonylamino)phenyl]-N-ethyl-piperazine-1-carboxamide Openeye Name: 4-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]-N-ethyl-piperazine-1-carboxamide CAS Name: 4-[4-[[1,3-benzodioxol-5-yl(oxo)methyl]amino]phenyl]-N-ethyl-1-piperazinecarboxamide IUPAC Name: 4-[4-(1,3-benzodioxole-5-carbonylamino)phenyl]-N-ethylpiperazine-1-carboxamide Traditional Name: N-ethyl-4-[4-(piperonyloylamino)phenyl]piperazine-1-carboxamide Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4

Isomeric SMILES

CCNC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H24N4O4/c1-2-22-21(27)25-11-9-24(10-12-25)17-6-4-16(5-7-17)23-20(26)15-3-8-18-19(13-15)29-14-28-18/h3-8,13H,2,9-12,14H2,1H3,(H,22,27)(H,23,26)