N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(diethylamino)-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(diethylamino)-3-oxidanylidene-prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(diethylcarbamoyl)vinyl]-3-nitro-benzamide CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(diethylamino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-(diethylamino)-3-oxoprop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(diethylcarbamoyl)vinyl]-3-nitro-benzamide Formula: C21H21N3O6 MolecularWeight: 411.40794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)/C(=C/C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O6/c1-3-23(4-2)21(26)17(10-14-8-9-18-19(11-14)30-13-29-18)22-20(25)15-6-5-7-16(12-15)24(27)28/h5-12H,3-4,13H2,1-2H3,(H,22,25)/b17-10-