N-[(Z)-1-(5-nitrofuran-2-yl)-3-oxidanylidene-3-(2-piperazin-4-ium-1-ylethylamino)prop-1-en-2-yl]furan-2-carboxamide

Systemtic Name: N-[(Z)-1-(5-nitrofuran-2-yl)-3-oxidanylidene-3-(2-piperazin-4-ium-1-ylethylamino)prop-1-en-2-yl]furan-2-carboxamide Openeye Name: N-[(Z)-2-(5-nitro-2-furyl)-1-(2-piperazin-4-ium-1-ylethylcarbamoyl)vinyl]furan-2-carboxamide CAS Name: N-[(Z)-1-(5-nitro-2-furanyl)-3-oxo-3-[2-(1-piperazin-4-iumyl)ethylamino]prop-1-en-2-yl]-2-furancarboxamide IUPAC Name: N-[(Z)-1-(5-nitrofuran-2-yl)-3-oxo-3-(2-piperazin-4-ium-1-ylethylamino)prop-1-en-2-yl]furan-2-carboxamide Traditional Name: N-[(Z)-2-(5-nitro-2-furyl)-1-(2-piperazin-4-ium-1-ylethylcarbamoyl)vinyl]-2-furamide Formula: C18H22N5O6+ MolecularWeight: 404.39718

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)CCNC(=O)C(=CC2=CC=C(O2)[N+](=O)[O-])NC(=O)C3=CC=CO3

Isomeric SMILES

C1CN(CC[NH2+]1)CCNC(=O)/C(=C/C2=CC=C(O2)[N+](=O)[O-])/NC(=O)C3=CC=CO3

InChI

InChI=1S/C18H21N5O6/c24-17(20-7-10-22-8-5-19-6-9-22)14(21-18(25)15-2-1-11-28-15)12-13-3-4-16(29-13)23(26)27/h1-4,11-12,19H,5-10H2,(H,20,24)(H,21,25)/p+1/b14-12-