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

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-piperidin-1-yl-prop-1-en-2-yl]-3-nitro-benzamide Openeye Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(piperidine-1-carbonyl)vinyl]-3-nitro-benzamide CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(1-piperidinyl)prop-1-en-2-yl]-3-nitrobenzamide IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-piperidin-1-ylprop-1-en-2-yl]-3-nitrobenzamide Traditional Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(piperidine-1-carbonyl)vinyl]-3-nitro-benzamide Formula: C22H21N3O6 MolecularWeight: 423.41864

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C(=CC2=CC3=C(C=C2)OCO3)NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C(=O)/C(=C/C2=CC3=C(C=C2)OCO3)/NC(=O)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H21N3O6/c26-21(16-5-4-6-17(13-16)25(28)29)23-18(22(27)24-9-2-1-3-10-24)11-15-7-8-19-20(12-15)31-14-30-19/h4-8,11-13H,1-3,9-10,14H2,(H,23,26)/b18-11-