3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide

Systemtic Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide Openeye Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N,N-diethyl-benzamide CAS Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)-1-oxoprop-2-enyl]amino]-N,N-diethylbenzamide IUPAC Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-N,N-diethylbenzamide Traditional Name: 3-[[(E)-3-(1,3-benzodioxol-5-yl)acryloyl]amino]-N,N-diethyl-benzamide Formula: C21H22N2O4 MolecularWeight: 366.41038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CCN(CC)C(=O)C1=CC(=CC=C1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C21H22N2O4/c1-3-23(4-2)21(25)16-6-5-7-17(13-16)22-20(24)11-9-15-8-10-18-19(12-15)27-14-26-18/h5-13H,3-4,14H2,1-2H3,(H,22,24)/b11-9+