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

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]propanamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propanamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propionamide Formula: C19H19ClN4O8S MolecularWeight: 498.89416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C19H19ClN4O8S/c1-12(19(25)21-16-10-13(23(26)27)4-6-15(16)20)32-18-7-5-14(11-17(18)24(28)29)33(30,31)22-8-2-3-9-22/h4-7,10-12H,2-3,8-9H2,1H3,(H,21,25)