4-(4-ethanoylpiperazin-1-yl)-N-(furan-2-ylmethyl)-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-(furan-2-ylmethyl)-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-(2-furylmethyl)-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-(2-furanylmethyl)-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-(furan-2-ylmethyl)-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-(2-furfuryl)-3-nitro-benzamide Formula: C18H20N4O5 MolecularWeight: 372.3752

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5/c1-13(23)20-6-8-21(9-7-20)16-5-4-14(11-17(16)22(25)26)18(24)19-12-15-3-2-10-27-15/h2-5,10-11H,6-9,12H2,1H3,(H,19,24)