2-[methyl-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)amino]-N-propyl-ethanamide

Systemtic Name: 2-[methyl-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)amino]-N-propyl-ethanamide Openeye Name: 2-(N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonyl-anilino)-N-propyl-acetamide CAS Name: 2-[N-methyl-2-nitro-4-(1-pyrrolidinylsulfonyl)anilino]-N-propylacetamide IUPAC Name: 2-(N-methyl-2-nitro-4-pyrrolidin-1-ylsulfonylanilino)-N-propylacetamide Traditional Name: 2-(N-methyl-2-nitro-4-pyrrolidinosulfonyl-anilino)-N-propyl-acetamide Formula: C16H24N4O5S MolecularWeight: 384.45056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H24N4O5S/c1-3-8-17-16(21)12-18(2)14-7-6-13(11-15(14)20(22)23)26(24,25)19-9-4-5-10-19/h6-7,11H,3-5,8-10,12H2,1-2H3,(H,17,21)