N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide

Systemtic Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxidanylidene-propyl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide Openeye Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxo-propyl]-5-(2,5-dimethylphenyl)isoxazole-3-carboxamide CAS Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-5-(2,5-dimethylphenyl)-3-isoxazolecarboxamide IUPAC Name: N-[3-(1,3-benzodioxol-5-ylmethylamino)-3-oxopropyl]-5-(2,5-dimethylphenyl)-1,2-oxazole-3-carboxamide Traditional Name: 5-(2,5-dimethylphenyl)-N-[3-keto-3-(piperonylamino)propyl]isoxazole-3-carboxamide Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2=CC(=NO2)C(=O)NCCC(=O)NCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=CC(=C(C=C1)C)C2=CC(=NO2)C(=O)NCCC(=O)NCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C23H23N3O5/c1-14-3-4-15(2)17(9-14)20-11-18(26-31-20)23(28)24-8-7-22(27)25-12-16-5-6-19-21(10-16)30-13-29-19/h3-6,9-11H,7-8,12-13H2,1-2H3,(H,24,28)(H,25,27)