1-(2-methyl-5-nitro-phenyl)sulfonyl-N-pentan-3-yl-piperidine-4-carboxamide

Systemtic Name: 1-(2-methyl-5-nitro-phenyl)sulfonyl-N-pentan-3-yl-piperidine-4-carboxamide Openeye Name: N-(1-ethylpropyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-pentan-3-yl-4-piperidinecarboxamide IUPAC Name: 1-(2-methyl-5-nitrophenyl)sulfonyl-N-pentan-3-ylpiperidine-4-carboxamide Traditional Name: N-(1-ethylpropyl)-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C18H27N3O5S MolecularWeight: 397.48908

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

Isomeric SMILES

CCC(CC)NC(=O)C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)[N+](=O)[O-])C

InChI

InChI=1S/C18H27N3O5S/c1-4-15(5-2)19-18(22)14-8-10-20(11-9-14)27(25,26)17-12-16(21(23)24)7-6-13(17)3/h6-7,12,14-15H,4-5,8-11H2,1-3H3,(H,19,22)