N-butyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-butyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-butyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-butyl-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-butyl-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: butyl-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C14H21N3O4S MolecularWeight: 327.39924

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCNC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C14H21N3O4S/c1-2-3-8-15-13-7-6-12(11-14(13)17(18)19)22(20,21)16-9-4-5-10-16/h6-7,11,15H,2-5,8-10H2,1H3