N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-2-methyl-3,5-dinitro-benzamide

Systemtic Name: N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-2-methyl-3,5-dinitro-benzamide Openeye Name: N-[4-[(2-ethyl-1-piperidyl)sulfonyl]phenyl]-2-methyl-3,5-dinitro-benzamide CAS Name: N-[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]-2-methyl-3,5-dinitrobenzamide IUPAC Name: N-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]-2-methyl-3,5-dinitrobenzamide Traditional Name: N-[4-(2-ethylpiperidino)sulfonylphenyl]-2-methyl-3,5-dinitro-benzamide Formula: C21H24N4O7S MolecularWeight: 476.50286

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3C)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC(=CC(=C3C)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H24N4O7S/c1-3-16-6-4-5-11-23(16)33(31,32)18-9-7-15(8-10-18)22-21(26)19-12-17(24(27)28)13-20(14(19)2)25(29)30/h7-10,12-13,16H,3-6,11H2,1-2H3,(H,22,26)