4-(4-ethanoylpiperazin-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-nitro-benzamide

Systemtic Name: 4-(4-ethanoylpiperazin-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-nitro-benzamide Openeye Name: 4-(4-acetylpiperazin-1-yl)-N-[1-(2-methylpropanoyl)-4-piperidyl]-3-nitro-benzamide CAS Name: 4-(4-acetyl-1-piperazinyl)-N-[1-(2-methyl-1-oxopropyl)-4-piperidinyl]-3-nitrobenzamide IUPAC Name: 4-(4-acetylpiperazin-1-yl)-N-[1-(2-methylpropanoyl)piperidin-4-yl]-3-nitrobenzamide Traditional Name: 4-(4-acetylpiperazino)-N-(1-isobutyryl-4-piperidyl)-3-nitro-benzamide Formula: C22H31N5O5 MolecularWeight: 445.51204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

Isomeric SMILES

CC(C)C(=O)N1CCC(CC1)NC(=O)C2=CC(=C(C=C2)N3CCN(CC3)C(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C22H31N5O5/c1-15(2)22(30)26-8-6-18(7-9-26)23-21(29)17-4-5-19(20(14-17)27(31)32)25-12-10-24(11-13-25)16(3)28/h4-5,14-15,18H,6-13H2,1-3H3,(H,23,29)