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

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(phenethylamino)prop-1-en-2-yl]benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]benzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]benzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]benzamide Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NCCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(\C(=O)NCCC3=CC=CC=C3)/NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O4/c28-24(20-9-5-2-6-10-20)27-21(15-19-11-12-22-23(16-19)31-17-30-22)25(29)26-14-13-18-7-3-1-4-8-18/h1-12,15-16H,13-14,17H2,(H,26,29)(H,27,28)/b21-15+