N-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethyl]-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethyl]-4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]ethyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]ethyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethyl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-[2-(2,2-dimethylcoumaran-7-yl)oxyethyl]-3-nitro-benzamide Formula: C25H30N4O6 MolecularWeight: 482.5289

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCOC3=CC=CC4=C3OC(C4)(C)C)[N+](=O)[O-]

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=C(C=C2)C(=O)NCCOC3=CC=CC4=C3OC(C4)(C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H30N4O6/c1-17(30)27-10-12-28(13-11-27)20-8-7-18(15-21(20)29(32)33)24(31)26-9-14-34-22-6-4-5-19-16-25(2,3)35-23(19)22/h4-8,15H,9-14,16H2,1-3H3,(H,26,31)