N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(phenethylamino)prop-1-en-2-yl]-4-methyl-benzamide

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(phenethylamino)prop-1-en-2-yl]-4-methyl-benzamide Openeye Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]-4-methyl-benzamide CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]-4-methylbenzamide IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]-4-methylbenzamide Traditional Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]-4-methyl-benzamide Formula: C26H24N2O4 MolecularWeight: 428.47976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC(=CC2=CC3=C(C=C2)OCO3)C(=O)NCCC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N/C(=C\C2=CC3=C(C=C2)OCO3)/C(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C26H24N2O4/c1-18-7-10-21(11-8-18)25(29)28-22(15-20-9-12-23-24(16-20)32-17-31-23)26(30)27-14-13-19-5-3-2-4-6-19/h2-12,15-16H,13-14,17H2,1H3,(H,27,30)(H,28,29)/b22-15-