N-(2-methoxy-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide

Systemtic Name: N-(2-methoxy-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide Openeye Name: N-(2-methoxy-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide CAS Name: N-(2-methoxy-5-nitrophenyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]propanamide IUPAC Name: N-(2-methoxy-5-nitrophenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propanamide Traditional Name: N-(2-methoxy-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propionamide Formula: C20H22N4O9S MolecularWeight: 494.47508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])OC)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H22N4O9S/c1-13(20(25)21-16-11-14(23(26)27)5-7-18(16)32-2)33-19-8-6-15(12-17(19)24(28)29)34(30,31)22-9-3-4-10-22/h5-8,11-13H,3-4,9-10H2,1-2H3,(H,21,25)