N-[4-[bis(fluoranyl)methoxy]phenyl]-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[4-[bis(fluoranyl)methoxy]phenyl]-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(difluoromethoxy)phenyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[4-(difluoromethoxy)phenyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[4-(difluoromethoxy)phenyl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-[4-(difluoromethoxy)phenyl]-3-nitro-benzamide Formula: C20H20F2N4O5 MolecularWeight: 434.393406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC(F)F)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC3=CC=C(C=C3)OC(F)F)[N+](=O)[O-]

InChI

InChI=1S/C20H20F2N4O5/c1-13(27)24-8-10-25(11-9-24)17-7-2-14(12-18(17)26(29)30)19(28)23-15-3-5-16(6-4-15)31-20(21)22/h2-7,12,20H,8-11H2,1H3,(H,23,28)