N-[4-(4-ethanoylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide

Systemtic Name: N-[4-(4-ethanoylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide Openeye Name: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitro-benzamide CAS Name: N-[4-(4-acetyl-1-piperazinyl)phenyl]-4-ethoxy-3-nitrobenzamide IUPAC Name: N-[4-(4-acetylpiperazin-1-yl)phenyl]-4-ethoxy-3-nitrobenzamide Traditional Name: N-[4-(4-acetylpiperazino)phenyl]-4-ethoxy-3-nitro-benzamide Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O5/c1-3-30-20-9-4-16(14-19(20)25(28)29)21(27)22-17-5-7-18(8-6-17)24-12-10-23(11-13-24)15(2)26/h4-9,14H,3,10-13H2,1-2H3,(H,22,27)