N-(ethylcarbamoyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide

Systemtic Name: N-(ethylcarbamoyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide Openeye Name: N-(ethylcarbamoyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide CAS Name: N-(ethylcarbamoyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]propanamide IUPAC Name: N-(ethylcarbamoyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propanamide Traditional Name: N-(ethylcarbamoyl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propionamide Formula: C16H22N4O7S MolecularWeight: 414.43348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC(=O)C(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCNC(=O)NC(=O)C(C)OC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H22N4O7S/c1-3-17-16(22)18-15(21)11(2)27-14-7-6-12(10-13(14)20(23)24)28(25,26)19-8-4-5-9-19/h6-7,10-11H,3-5,8-9H2,1-2H3,(H2,17,18,21,22)