[5-(4-nitrophenyl)furan-2-yl]-(4-propylpiperazin-4-ium-1-yl)methanone

Systemtic Name: [5-(4-nitrophenyl)furan-2-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Openeye Name: [5-(4-nitrophenyl)-2-furyl]-(4-propylpiperazin-4-ium-1-yl)methanone CAS Name: [5-(4-nitrophenyl)-2-furanyl]-(4-propyl-1-piperazin-4-iumyl)methanone IUPAC Name: [5-(4-nitrophenyl)furan-2-yl]-(4-propylpiperazin-4-ium-1-yl)methanone Traditional Name: [5-(4-nitrophenyl)-2-furyl]-(4-propylpiperazin-4-ium-1-yl)methanone Formula: C18H22N3O4+ MolecularWeight: 344.38498

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCC[NH+]1CCN(CC1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H21N3O4/c1-2-9-19-10-12-20(13-11-19)18(22)17-8-7-16(25-17)14-3-5-15(6-4-14)21(23)24/h3-8H,2,9-13H2,1H3/p+1