N-[(Z)-3-(butylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-iodanyl-benzamide

Systemtic Name: N-[(Z)-3-(butylamino)-1-(3-nitrophenyl)-3-oxidanylidene-prop-1-en-2-yl]-2-iodanyl-benzamide Openeye Name: N-[(Z)-1-(butylcarbamoyl)-2-(3-nitrophenyl)vinyl]-2-iodo-benzamide CAS Name: N-[(Z)-3-(butylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-iodobenzamide IUPAC Name: N-[(Z)-3-(butylamino)-1-(3-nitrophenyl)-3-oxoprop-1-en-2-yl]-2-iodobenzamide Traditional Name: N-[(Z)-1-(butylcarbamoyl)-2-(3-nitrophenyl)vinyl]-2-iodo-benzamide Formula: C20H20IN3O4 MolecularWeight: 493.29497

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(=CC1=CC(=CC=C1)[N+](=O)[O-])NC(=O)C2=CC=CC=C2I

Isomeric SMILES

CCCCNC(=O)/C(=C/C1=CC(=CC=C1)[N+](=O)[O-])/NC(=O)C2=CC=CC=C2I

InChI

InChI=1S/C20H20IN3O4/c1-2-3-11-22-20(26)18(13-14-7-6-8-15(12-14)24(27)28)23-19(25)16-9-4-5-10-17(16)21/h4-10,12-13H,2-3,11H2,1H3,(H,22,26)(H,23,25)/b18-13-