N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-aniline

Systemtic Name: N-methyl-2-nitro-4-piperidin-1-ylsulfonyl-aniline Openeye Name: N-methyl-2-nitro-4-(1-piperidylsulfonyl)aniline CAS Name: N-methyl-2-nitro-4-(1-piperidinylsulfonyl)aniline IUPAC Name: N-methyl-2-nitro-4-piperidin-1-ylsulfonylaniline Traditional Name: methyl-(2-nitro-4-piperidinosulfonyl-phenyl)amine Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

Isomeric SMILES

CNC1=C(C=C(C=C1)S(=O)(=O)N2CCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C12H17N3O4S/c1-13-11-6-5-10(9-12(11)15(16)17)20(18,19)14-7-3-2-4-8-14/h5-6,9,13H,2-4,7-8H2,1H3