4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzaldehyde

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-3-nitro-benzaldehyde Openeye Name: 4-(4-acetylpiperazin-1-yl)-3-nitro-benzaldehyde CAS Name: 4-(4-acetyl-1-piperazinyl)-3-nitrobenzaldehyde IUPAC Name: 4-(4-acetylpiperazin-1-yl)-3-nitrobenzaldehyde Traditional Name: 4-(4-acetylpiperazino)-3-nitro-benzaldehyde Formula: C13H15N3O4 MolecularWeight: 277.2759

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N3O4/c1-10(18)14-4-6-15(7-5-14)12-3-2-11(9-17)8-13(12)16(19)20/h2-3,8-9H,4-7H2,1H3