4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide

Systemtic Name: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxidanylidene-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Openeye Name: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxo-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide CAS Name: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethoxy]-N-(2,5-dimethyl-1-pyrrolyl)benzamide IUPAC Name: 4-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Traditional Name: 4-[2-(1,3-benzodioxol-5-ylamino)-2-keto-ethoxy]-N-(2,5-dimethylpyrrol-1-yl)benzamide Formula: C22H21N3O5 MolecularWeight: 407.41924

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC=C(N1NC(=O)C2=CC=C(C=C2)OCC(=O)NC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C22H21N3O5/c1-14-3-4-15(2)25(14)24-22(27)16-5-8-18(9-6-16)28-12-21(26)23-17-7-10-19-20(11-17)30-13-29-19/h3-11H,12-13H2,1-2H3,(H,23,26)(H,24,27)