N-[2-[[4-(tert-butylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[[4-(tert-butylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[4-[(tert-butylamino)-oxomethyl]anilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[4-(tert-butylcarbamoyl)anilino]-2-keto-ethyl]-piperonylamide Formula: C21H23N3O5 MolecularWeight: 397.42442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=C(C=C1)NC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H23N3O5/c1-21(2,3)24-20(27)13-4-7-15(8-5-13)23-18(25)11-22-19(26)14-6-9-16-17(10-14)29-12-28-16/h4-10H,11-12H2,1-3H3,(H,22,26)(H,23,25)(H,24,27)