N,N-dimethyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N,N-dimethyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N,N-dimethyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N,N-dimethyl-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N,N-dimethyl-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: dimethyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C12H17N3O4S MolecularWeight: 299.34608

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CN(C)C1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

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