N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(prop-2-enylamino)prop-1-en-2-yl]-4-bromanyl-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(prop-2-enylamino)prop-1-en-2-yl]-4-bromanyl-benzamide Openeye Name: N-[(E)-1-(allylcarbamoyl)-2-(1,3-benzodioxol-5-yl)vinyl]-4-bromo-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(prop-2-enylamino)prop-1-en-2-yl]-4-bromobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(prop-2-enylamino)prop-1-en-2-yl]-4-bromobenzamide Traditional Name: N-[(E)-1-(allylcarbamoyl)-2-(1,3-benzodioxol-5-yl)vinyl]-4-bromo-benzamide Formula: C20H17BrN2O4 MolecularWeight: 429.26398

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=C(C=C3)Br

Isomeric SMILES

C=CCNC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H17BrN2O4/c1-2-9-22-20(25)16(23-19(24)14-4-6-15(21)7-5-14)10-13-3-8-17-18(11-13)27-12-26-17/h2-8,10-11H,1,9,12H2,(H,22,25)(H,23,24)/b16-10+