2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide

Systemtic Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-N-pentan-3-yl-ethanamide Openeye Name: N-(1-ethylpropyl)-2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: 2-[4-(2-nitrophenyl)sulfonyl-1-piperazinyl]-N-pentan-3-ylacetamide IUPAC Name: 2-[4-(2-nitrophenyl)sulfonylpiperazin-1-yl]-N-pentan-3-ylacetamide Traditional Name: N-(1-ethylpropyl)-2-[4-(2-nitrophenyl)sulfonylpiperazino]acetamide Formula: C17H26N4O5S MolecularWeight: 398.47714

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

Isomeric SMILES

CCC(CC)NC(=O)CN1CCN(CC1)S(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C17H26N4O5S/c1-3-14(4-2)18-17(22)13-19-9-11-20(12-10-19)27(25,26)16-8-6-5-7-15(16)21(23)24/h5-8,14H,3-4,9-13H2,1-2H3,(H,18,22)