N-cyclopentyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-cyclopentyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-cyclopentyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-cyclopentyl-1-(2-methyl-5-nitrophenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-cyclopentyl-1-(2-methyl-5-nitrophenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-cyclopentyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-isonipecotamide Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCC3

InChI

InChI=1S/C18H25N3O5S/c1-13-6-7-16(21(23)24)12-17(13)27(25,26)20-10-8-14(9-11-20)18(22)19-15-4-2-3-5-15/h6-7,12,14-15H,2-5,8-11H2,1H3,(H,19,22)