4-methyl-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine

Systemtic Name: 4-methyl-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine Openeye Name: 4-methyl-1-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)piperidine CAS Name: 4-methyl-1-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]piperidine IUPAC Name: 4-methyl-1-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)piperidine Traditional Name: 4-methyl-1-(2-nitro-4-pyrrolidinosulfonyl-phenyl)piperidine Formula: C16H23N3O4S MolecularWeight: 353.43652

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O4S/c1-13-6-10-17(11-7-13)15-5-4-14(12-16(15)19(20)21)24(22,23)18-8-2-3-9-18/h4-5,12-13H,2-3,6-11H2,1H3