3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide

Systemtic Name: 3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]benzamide Openeye Name: 3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide CAS Name: 3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]benzamide IUPAC Name: 3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethylpyrrol-3-yl]methylideneamino]benzamide Traditional Name: 3-acetamido-N-[[1-(1,3-benzodioxol-5-yl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]benzamide Formula: C23H22N4O4 MolecularWeight: 418.44518

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C=NNC(=O)C4=CC(=CC=C4)NC(=O)C

Isomeric SMILES

CC1=CC(=C(N1C2=CC3=C(C=C2)OCO3)C)C=NNC(=O)C4=CC(=CC=C4)NC(=O)C

InChI

InChI=1S/C23H22N4O4/c1-14-9-18(15(2)27(14)20-7-8-21-22(11-20)31-13-30-21)12-24-26-23(29)17-5-4-6-19(10-17)25-16(3)28/h4-12H,13H2,1-3H3,(H,25,28)(H,26,29)