4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitro-aniline

Systemtic Name: 4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitro-aniline Openeye Name: 4-[(2,6-dimethyl-1-piperidyl)sulfonyl]-2-nitro-aniline CAS Name: 4-[(2,6-dimethyl-1-piperidinyl)sulfonyl]-2-nitroaniline IUPAC Name: 4-(2,6-dimethylpiperidin-1-yl)sulfonyl-2-nitroaniline Traditional Name: [4-(2,6-dimethylpiperidino)sulfonyl-2-nitro-phenyl]amine Formula: C13H19N3O4S MolecularWeight: 313.37266

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(N1S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C

Isomeric SMILES

CC1CCCC(N1S(=O)(=O)C2=CC(=C(C=C2)N)[N+](=O)[O-])C

InChI

InChI=1S/C13H19N3O4S/c1-9-4-3-5-10(2)15(9)21(19,20)11-6-7-12(14)13(8-11)16(17)18/h6-10H,3-5,14H2,1-2H3