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

Systemtic Name: (2R)-N-(1-cyanocyclohexyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide Openeye Name: (2R)-N-(1-cyanocyclohexyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenoxy)propanamide CAS Name: (2R)-N-(1-cyanocyclohexyl)-2-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenoxy]propanamide IUPAC Name: (2R)-N-(1-cyanocyclohexyl)-2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenoxy)propanamide Traditional Name: (2R)-N-(1-cyanocyclohexyl)-2-(2-nitro-4-pyrrolidinosulfonyl-phenoxy)propionamide Formula: C20H26N4O6S MolecularWeight: 450.50864

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1(CCCCC1)C#N)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1(CCCCC1)C#N)OC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H26N4O6S/c1-15(19(25)22-20(14-21)9-3-2-4-10-20)30-18-8-7-16(13-17(18)24(26)27)31(28,29)23-11-5-6-12-23/h7-8,13,15H,2-6,9-12H2,1H3,(H,22,25)/t15-/m1/s1