1-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-4-amine

Systemtic Name: 1-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-4-amine Openeye Name: 1-methyl-N-(4-methylsulfonyl-2-nitro-phenyl)piperidin-4-amine CAS Name: 1-methyl-N-(4-methylsulfonyl-2-nitrophenyl)-4-piperidinamine IUPAC Name: 1-methyl-N-(4-methylsulfonyl-2-nitrophenyl)piperidin-4-amine Traditional Name: (4-mesyl-2-nitro-phenyl)-(1-methyl-4-piperidyl)amine Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

Isomeric SMILES

CN1CCC(CC1)NC2=C(C=C(C=C2)S(=O)(=O)C)[N+](=O)[O-]

InChI

InChI=1S/C13H19N3O4S/c1-15-7-5-10(6-8-15)14-12-4-3-11(21(2,19)20)9-13(12)16(17)18/h3-4,9-10,14H,5-8H2,1-2H3