N-[2-oxidanylidene-2-[2-(1-phenylpyrazol-4-yl)ethylamino]ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-oxidanylidene-2-[2-(1-phenylpyrazol-4-yl)ethylamino]ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-oxo-2-[2-(1-phenylpyrazol-4-yl)ethylamino]ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-oxo-2-[2-(1-phenyl-4-pyrazolyl)ethylamino]ethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-oxo-2-[2-(1-phenylpyrazol-4-yl)ethylamino]ethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-keto-2-[2-(1-phenylpyrazol-4-yl)ethylamino]ethyl]-piperonylamide Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NCCC3=CN(N=C3)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)NCC(=O)NCCC3=CN(N=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H20N4O4/c26-20(12-23-21(27)16-6-7-18-19(10-16)29-14-28-18)22-9-8-15-11-24-25(13-15)17-4-2-1-3-5-17/h1-7,10-11,13H,8-9,12,14H2,(H,22,26)(H,23,27)